Tubastatin A structure, CAS 1239262-52-2

Tubastatin A

CAS Number1239262-52-2

SynonymsTUBASTATIN A HYDROCHLORIDE; N-hydroxy-4-({2-methyl-1H,3H,4H-pyrido[4,3-b]indol-5-yl}methyl)benzamide hydrochloride; N-Hydroxy-4-[(2-methyl-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5-yl)methyl]benzamide; Tubastatin A Trifluoroacetic Acid Salt; TUBASTSTINA HCL; TUBASTATIN A ((2-METHYL-3,4-DIHYDRO-1H-PYRIDO[4,3-B]-INDOL- 5(2H)-YL)METHYL)BENZAMIDE); TUBASTATIN A_HCL; Tubastatin A; TUBASTANTIN A; Tubastatin A (trifluoroacetate salt); TRIETHYLENETHIOPHOSPHORAMIDE,WHITE SOLID; [4-({2-methyl-1H,2H,3H,4H,5H-pyrido[4,3-b]indol-5-yl}methyl)phenyl]formamido 2,2,2-trifluoroacetate; N-Hydroxy-4-[(2-methyl-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5 -yl)methyl]benzamide; N-hydroxy-4-((2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5(2H)-yl)methyl)benzamide

Molecular FormulaC22H22F3N3O4

Molecular Weight371.86

Purity≥98 (HPLC)%

Density1.3±0.1 g/cm3

Boiling Point

Melting Point

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-3178167 Purity: ≥98 (HPLC)%
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Quality Control of [ 1239262-52-2 ] Purity: ≥98 (HPLC)% SDS Specification MoL

Chemical & Physical Properties
CAS Number1239262-52-2
Catalog No.2A-3178167
Chinese NameN-羟基-4-[(1,2,3,4-四氢-2-甲基-5H-吡啶并[4,3-b]吲哚-5-基)甲基]苯甲酰胺 2,2,2-三氟乙酸酯
SynonymsTUBASTATIN A HYDROCHLORIDE; N-hydroxy-4-({2-methyl-1H,3H,4H-pyrido[4,3-b]indol-5-yl}methyl)benzamide hydrochloride; N-Hydroxy-4-[(2-methyl-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5-yl)methyl]benzamide; Tubastatin A Trifluoroacetic Acid Salt; TUBASTSTINA HCL; TUBASTATIN A ((2-METHYL-3,4-DIHYDRO-1H-PYRIDO[4,3-B]-INDOL- 5(2H)-YL)METHYL)BENZAMIDE); TUBASTATIN A_HCL; Tubastatin A; TUBASTANTIN A; Tubastatin A (trifluoroacetate salt); TRIETHYLENETHIOPHOSPHORAMIDE,WHITE SOLID; [4-({2-methyl-1H,2H,3H,4H,5H-pyrido[4,3-b]indol-5-yl}methyl)phenyl]formamido 2,2,2-trifluoroacetate; N-Hydroxy-4-[(2-methyl-1,2,3,4-tetrahydro-5H-pyrido[4,3-b]indol-5 -yl)methyl]benzamide; N-hydroxy-4-((2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5(2H)-yl)methyl)benzamide
Molecular FormulaC22H22F3N3O4
Molecular Weight371.86
Purity≥98 (HPLC)
Density1.3±0.1 g/cm3
Appearancepowder
Storage Conditionroom temperature
ApplicationTubastatin A (TSA) TFA is a potent, selective inhibitor of HDAC6 with an IC50 of 15 nM and is over 1000-fold selective for isoforms other than HDAC8. Tubastatin A TFA also inhibits HDAC10 and MBLAC2.
PubChem ID329825114
MDL NumberMFCD20488052
SMILESO=C(NO)C1=CC=C(CN2C3=C(C=CC=C3)C4=C2CCN(C)C4)C=C1.Cl
InChI1S/C20H21N3O2.ClH/c1-22-11-10-19-17(13-22)16-4-2-3-5-18(16)23(19)12-14-6-8-15(9-7-14)20(24)21-25;/h2-9,25H,10-13H2,1H3,(H,21,24);1H
InChI KeyLJTSJTWIMOGKRJ-UHFFFAOYSA-N
NACRES CodeNA.77
UNSPSC12352200
MSDSmsds/178800_1_1239262_52_2.pdf
Transport InfoProduct Name: Tobastatin Hydrochloride A
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