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Home > Products > Specialty & Industrial Chemicals > Specialty Chemicals > 2-(3-(DIISOPROPYLAMINO)-1-PHENYLPROPYL)-4-(HYDROXYMETHYL)PHENOL
2-(3-(DIISOPROPYLAMINO)-1-PHENYLPROPYL)-4-(HYDROXYMETHYL)PHENOL structure, CAS 200801-70-3

2-(3-(DIISOPROPYLAMINO)-1-PHENYLPROPYL)-4-(HYDROXYMETHYL)PHENOL

CAS Number200801-70-3

SynonymsN,N-diisopropyl-3-(2-hydroxy-5-hydroxymethylphenyl)-3-phenylpropylamine; RS-N,N-diisopropyl-3-(2-hydroxy-5-(hydroxymethyl)phenyl)-3-phenylpropylamine; 2-(3-diisopropylamino-1-phenylpropyl)-4-hydroxymethylphenol; 2-[3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenol; rac 5-Hydroxymethyl Tolterodine; feso deacyl raceme; (R)-2-[3-(diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenol; 3-[3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-hydroxybenzenemethanol; Fesoterodine fumarate Intermediate 1

Molecular FormulaC22H31NO2

Molecular Weight341.49

Purity96+%

Density1.1±0.1 g/cm3

Boiling Point490.7±45.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS0

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Cat. No.: 2A-0114476 Purity: 96+%
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Quality Control of [ 200801-70-3 ] Purity: 96+% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number200801-70-3
Catalog No.2A-0114476
Chinese Name2-(3-(二异丙氨基)-1-苯基丙基)-4-(羟甲基)苯酚
SynonymsN,N-diisopropyl-3-(2-hydroxy-5-hydroxymethylphenyl)-3-phenylpropylamine; RS-N,N-diisopropyl-3-(2-hydroxy-5-(hydroxymethyl)phenyl)-3-phenylpropylamine; 2-(3-diisopropylamino-1-phenylpropyl)-4-hydroxymethylphenol; 2-[3-(Diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenol; rac 5-Hydroxymethyl Tolterodine; feso deacyl raceme; (R)-2-[3-(diisopropylamino)-1-phenylpropyl]-4-(hydroxymethyl)phenol; 3-[3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-hydroxybenzenemethanol; Fesoterodine fumarate Intermediate 1
Molecular FormulaC22H31NO2
Molecular Weight341.49
Purity96+
Density1.1±0.1 g/cm3
Boiling Point490.7±45.0 °C at 760 mmHg
Storage Conditionroom temperature
Application(Rac)-5-hydroxymethyl tolterodine ((Rac)-defexotodine), the active metabolite of tolterodine, is an mAChR antagonist (Ki values ​​for M1, M2, M3, M4, and M5 receptors are 2.3 nM, 2 nM, 2.5 nM, 2.8 nM,
EINECS0
HTC2922509090
UN(IATA)0
SMILESCC(C)N(CCC(c1ccccc1)c1cc(CO)ccc1O)C(C)C
InChI KeyDUXZAXCGJSBGDW-UHFFFAOYSA-N
Use of(Rac)-5-Hydroxymethyl Tolterodine ((Rac)-Desfesoterodine), an active metabolite of Tolterodine, is a mAChR antagonist (Ki values of 2.3 nM, 2 nM, 2.5 nM, 2.8 nM, and 2.9 nM for M1, M2, M3, M4, and M5 receptors, respectively). (Rac)-5-Hydroxymethyl Tolterodine can be used for overactive bladder research[1]. Properties Name 2-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-(hydroxymethyl)phenol Synonym More Synonyms (Rac)-5-Hydroxymethyl Tolterodine Biological Activity Description (Rac)-5-Hydroxymethyl Tolterodine ((Rac)-Desfesoterodine), an active metabolite of Tolterodine, is a mAChR antagonist (Ki values of 2.3 nM, 2 nM, 2.5 nM, 2.8 nM, and 2.9 nM for M1, M2, M3, M4, and M5 receptors, respectively). (Rac)-5-Hydroxymethyl Tolterodine can be used for overactive bladder research[1]. Related Catalog Signaling Pathways >> Neuronal Signaling >> mAChR Signaling Pathways >> GPCR/G Protein >> mAChR Research Areas >> Neurological Disease Ki: M1 (2.3 nM), M2 (2 nM), M3 (2.5 nM), M4 (2.8 nM), and M5 (2.9 nM)[1] In Vitro In vitro, (Rac)-5-Hydroxymethyl Tolterodine (PNU-200577) produces a competitive and concentration-dependent inhibition of carbachol-induced contraction of guinea-pig isolated urinary bladder strips (KB of 0.84 nM; pA2 of 9.14)[2]. In Vivo (Rac)-5-Hydroxymethyl Tolterodine (5-HMT; 0.88 μmol/kg; i.v.) treatment shows the binding activity of (Rac)-5-Hydroxymethyl Tolterodine to muscarinic receptors is significantly observed in all tissues, except cerebral cortex, with a longer duration in bladder[3]. References [1]. L Nilvebrant, et al. Antimuscarinic potency and bladder selectivity of PNU-200577, a major metabolite of tolterodine. Pharmacol Toxicol. 1997 Oct;81(4):169-72. [2]. B Malhotra, et al. The design and development of fesoterodine as a prodrug of 5-hydroxymethyl tolterodine (5-HMT), the active metabolite of tolterodine. Curr Med Chem. 2009;16(33):4481-9. [3]. Shizuo Yamada, et al. Muscarinic receptor binding of fesoterodine, 5-hydroxymethyl tolterodine, and tolterodine in rat tissues after the oral, intravenous, or intravesical administration. J Pharmacol Sci. 2019 May;140(1):73-78. Chemical & Physical Properties Molecular Formula C22H31NO2 Exact Mass 341.235474 PSA 43.70000 Index of Refraction 1.563 InChIKey DUXZAXCGJSBGDW-UHFFFAOYSA-N Safety Information Hazard Codes Xi HS Code 2922509090 Synthetic Route (+)-N,N-diisopr... 250214-39-2 (Rac)-5-Hydroxy... 200801-70-3 Cinnamic aldehy... 14371-10-9 (Rac)-5-Hydroxy... 200801-70-3 Literature: Organic Process Research and Development, , vol. 15, # 5 p. 1010 - 1017 4-Hydroxybenzyl... (Rac)-5-Hydroxy... 200801-70-3 Literature: Organic Process Research and Development, , vol. 15, # 5 p. 1010 - 1017 Precursor & DownStream Precursor 9 CAS#:250214-39-2 (+)-N,N-diisopr... CAS#:14371-10-9 Cinnamic aldehyde CAS#:623-05-2 4-Hydroxybenzyl... CAS#:156755-23-6 6-Bromo-4-pheny... DownStream 2 CAS#:207679-81-0 5-hydroxymethyl... CAS#:286930-02-7 Fesoterodine
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