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4-(2-Chlorophenoxy)-N-[3-[(methylamino)carbonyl]phenyl]-1-piperidinecarboxamide structure, CAS 1032229-33-6

4-(2-Chlorophenoxy)-N-[3-[(methylamino)carbonyl]phenyl]-1-piperidinecarboxamide

CAS Number1032229-33-6

Synonyms(4-(2-chlorophenoxy)-N-(3-(methylcarbamoyl)-phenyl)piperidine-1-carboxamide); 4-(2-chlorophenoxy)-N-{3-[(methylamino)carbonyl]phenyl}piperidine-1-carboxamide; 4-(2-Chlorophenoxy)-N-[3-[(methylamino)carbonyl]phenyl]-1-piperidinecarboxamide; A939572

Molecular FormulaC20H22ClN3O3

Molecular Weight387.86

Purity≥98 (HPLC)%

Density1.302 g/cm3

Boiling Point633.5ºC at 760 mmHg

Melting Point

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9059510 Purity: ≥98 (HPLC)%
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Quality Control of [ 1032229-33-6 ] Purity: ≥98 (HPLC)% SDS Specification MoL

Chemical & Physical Properties
CAS Number1032229-33-6
Catalog No.2A-9059510
Chinese Name4-(2-氯苯氧基)-N-[3-[(甲基氨基)羰基]苯基]-1-哌啶甲酰胺
Synonyms(4-(2-chlorophenoxy)-N-(3-(methylcarbamoyl)-phenyl)piperidine-1-carboxamide); 4-(2-chlorophenoxy)-N-{3-[(methylamino)carbonyl]phenyl}piperidine-1-carboxamide; 4-(2-Chlorophenoxy)-N-[3-[(methylamino)carbonyl]phenyl]-1-piperidinecarboxamide; A939572
Molecular FormulaC20H22ClN3O3
Molecular Weight387.86
Purity≥98 (HPLC)
Density1.302 g/cm3
Boiling Point633.5ºC at 760 mmHg
Appearancepowder
Storage Condition2-8℃
ApplicationA939572 is an orally active SCD1 inhibitor with IC50 of <4 nM and 37 nM for mSCD1 and hSCD1, respectively.
HTC2933399090
MDL NumberMFCD10698997
SMILESClc1c(cccc1)OC2CCN(CC2)C(=O)Nc3cc(ccc3)C(=O)NC
InChI1S/C20H22ClN3O3/c1-22-19(25)14-5-4-6-15(13-14)23-20(26)24-11-9-16(10-12-24)27-18-8-3-2-7-17(18)21/h2-8,13,16H,9-12H2,1H3,(H,22,25)(H,23,26)
InChI KeyDPYTYQFYDLYWHZ-UHFFFAOYSA-N
NACRES CodeNA.77
UNSPSC12352200
MSDSmsds/59510_1_1032229_33_6.pdf
Use ofA939572 is a potent, and orally bioavailable SCD1 inhibitor with IC50 values of <4 nM and 37 nM for mSCD1 and hSCD1, respectively. Properties Name 4-(2-chlorophenoxy)-N-[3-(methylcarbamoyl)phenyl]piperidine-1-carboxamide Synonym More Synonyms A939572 Biological Activity Description A939572 is a potent, and orally bioavailable SCD1 inhibitor with IC50 values of <4 nM and 37 nM for mSCD1 and hSCD1, respectively. Related Catalog Signaling Pathways >> Metabolic Enzyme/Protease >> Stearoyl-CoA Desaturase (SCD) Research Areas >> Cancer IC50: <4 nM (mSCD1), 37 nM (hSCD1)[1] References [1]. Xin Z, et al. Discovery of piperidine-aryl urea-based stearoyl-CoA desaturase 1 inhibitors. Bioorg Med Chem Lett. 2008 Aug 1;18(15):4298-302. [2]. von Roemeling CA, et al. Stearoyl-CoA desaturase 1 is a novel molecular therapeutic target for clear cell renal cell carcinoma. Clin Cancer Res. 2013 May 1;19(9):2368-80. Chemical & Physical Properties Exact Mass 387.13500 PSA 70.67000 LogP 4.17670 InChIKey DPYTYQFYDLYWHZ-UHFFFAOYSA-N Storage condition 2-8℃ Safety Information HS Code 2933399090
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport InfoProduct name: Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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