Compound C25H38N2O2S

(3S,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol

CAS: 96687-24-0

Molecular Formula	`C25H38N2O2S`
Molecular Weight	430.6 g/mol
LogP	4.9
Topological Polar Surface Area	93.6 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	430.2654
Heavy Atoms	30
Complexity	713.0

Chemical Identifiers

CAS Number	96687-24-0
SMILES	`CC(C)NC1=NC(=CS1)C2(CCC3C2(CCC4C3CCC5=CC(CCC45C)O)C)O`
InChIKey	`BRTIEGAEDSTNID-HIYRCXEDSA-N`

📖 Product Overview

Compound C25H38N2O2S (CAS: 96687-24-0) is a chemical compound with molecular formula C25H38N2O2S and molecular weight 430.6 g/mol. Its IUPAC systematic name is (3S,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol. LogP 4.9 Topological Polar Surface Area 93.6 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 430.2654 Heavy Atoms 30 Complexity 713.0 InChI Key: BRTIEGAEDSTNID-HIYRCXEDSA-N. SMILES: CC(C)NC1=NC(=CS1)C2(CCC3C2(CCC4C3CCC5=CC(CCC45C)O)C)O.

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