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1800340-40-2

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1800340-40-2 Structure

1800340-40-2 Structure
IdentificationBack Directory
[Name]

BMS 986158
[CAS]

1800340-40-2
[Synonyms]

BMS 986158
BMS-986158;BMS 986158;BMS986158
BMS 986158,Epigenetic Reader Domain,inhibit,BMS-986158,Inhibitor,BMS986158
(S)-2-(3-(1,4-dimethyl-1H-1,2,3-triazol-5-yl)-5-(phenyl(tetrahydro-2H-pyran-4-yl)methyl)-5H-pyrido[3,2-b]indol-7-yl)propan-2-ol
5H-Pyrido[3,2-b]indole-7-methanol, 3-(1,4-dimethyl-1H-1,2,3-triazol-5-yl)-α,α-dimethyl-5-[(S)-phenyl(tetrahydro-2H-pyran-4-yl)methyl]-
[Molecular Formula]

C30H33N5O2
[MDL Number]

MFCD31544327
[MOL File]

1800340-40-2.mol
[Molecular Weight]

495.63
Chemical PropertiesBack Directory
[Boiling point ]

674.0±65.0 °C(Predicted)
[density ]

1.28±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO: 50 mM
[form ]

A solid
[pka]

14.31±0.29(Predicted)
[color ]

White to off-white
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Hazard InformationBack Directory
[Uses]

BMS-986158 is a potent BET inhibitor with IC50s of 6.6 and 5 nM in NCI-H211 small cell lung cancer (SCLC) cells and MDA-MB231 triple negative breast cancer (TNBC) cells, respectively[1].
[References]

[1] Yin M, et al. Potent BRD4 inhibitor suppresses cancer cell-macrophage interaction. Nat Commun. 2020 Apr 14;11(1):1833. DOI:10.1038/s41467-020-15290-0
Spectrum DetailBack Directory
[Spectrum Detail]

BMS 986158(1800340-40-2)1HNMR
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