Compound C29H36N2O2S

(8R,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-17-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one

CAS: 96269-23-7

Molecular Formula	`C29H36N2O2S`
Molecular Weight	476.7 g/mol
LogP	6.2
Topological Polar Surface Area	90.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	476.24976
Heavy Atoms	34
Complexity	853.0

Chemical Identifiers

CAS Number	96269-23-7
SMILES	`CC1=CC=C(C=C1)NC2=NC(=CS2)C3(CCC4C3(CCC5C4CCC6=CC(=O)CCC56C)C)O`
InChIKey	`PZNFLFXPQBPMJV-VHSKNJRQSA-N`

📖 Product Overview

Compound C29H36N2O2S (CAS: 96269-23-7) is a chemical compound with molecular formula C29H36N2O2S and molecular weight 476.7 g/mol. Its IUPAC systematic name is (8R,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-17-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one. LogP 6.2 Topological Polar Surface Area 90.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 476.24976 Heavy Atoms 34 Complexity 853.0 InChI Key: PZNFLFXPQBPMJV-VHSKNJRQSA-N. SMILES: CC1=CC=C(C=C1)NC2=NC(=CS2)C3(CCC4C3(CCC5C4CCC6=CC(=O)CCC56C)C)O.

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