Compound C30H40N2O2S

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

CAS: 97370-80-4

Molecular Formula	`C30H40N2O2S`
Molecular Weight	492.7 g/mol
LogP	6.1
Topological Polar Surface Area	84.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	492.28104
Heavy Atoms	35
Complexity	829.0

Chemical Identifiers

CAS Number	97370-80-4
SMILES	`CCN(C1=CC=CC=C1)C2=NC(=CS2)C3(CCC4C3(CCC5C4CCC6=CC(CCC56C)O)C)O`
InChIKey	`AMCODAOHAKUCKB-WKPYSDFXSA-N`

📖 Product Overview

Compound C30H40N2O2S (CAS: 97370-80-4) is a chemical compound with molecular formula C30H40N2O2S and molecular weight 492.7 g/mol. Its IUPAC systematic name is (3S,8R,9S,10R,13S,14S,17R)-17-[2-(N-ethylanilino)-1,3-thiazol-4-yl]-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol. LogP 6.1 Topological Polar Surface Area 84.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 492.28104 Heavy Atoms 35 Complexity 829.0 InChI Key: AMCODAOHAKUCKB-WKPYSDFXSA-N. SMILES: CCN(C1=CC=CC=C1)C2=NC(=CS2)C3(CCC4C3(CCC5C4CCC6=CC(CCC56C)O)C)O.

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