17-Isopentyloxy-4-azaandrostane structure

17-Isopentyloxy-4-azaandrostane

(1S,3aS,3bR,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-1-(3-methylbutoxy)-2,3,3a,3b,4,5,5a,6,7,8,9,9b,10,11-tetradecahydro-1H-indeno[5,4-f]quinoline

Also Known As: 17-Isopentyloxy-4-azaandrostane|17|A-isopentyloxy-4-aza-5|A-androstane|17beta-Isopentyloxy-4-aza-5alpha-androstane|17 beta-isopentyloxy-4-aza-5 alpha-androstane|4-Azaandrostane, 17-(3-methylbutoxy)-, (5alpha,17beta)-|(1S,3aS,3bR,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-1-(3-methylbutoxy)-2,3,3a,3b,4,5,5a,6,7,8,9,9b,10,11-tetradecahydro-1H-indeno[5,4-f]quinoline|4a,6a-Dimethyl-7-(3-methylbutoxy)hexadecahydro-1H-indeno[5,4-f]quinoline|(4aR,4bS,6aS,7S,9aS,9bR,11aR)-4a,6a-Dimethyl-7-(3-methylbutoxy)hexadecahydro-1H-indeno[5,4-f]quinoline

CAS: 5405-17-4
Molecular Formula C23H41NO
Molecular Weight 347.31882 g/mol
LogP 5.7
Topological Polar Surface Area 21.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 4
Exact Mass 347.31882
Monoisotopic Mass 347.31882
Heavy Atoms 25
Complexity 477.0

Chemical Identifiers

CAS Number 5405-17-4
SMILES CC(C)CCO[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCN4)C)C
InChIKey ORKPWGVBNZILAL-NNXZOMJWSA-N

Product Overview

17-Isopentyloxy-4-azaandrostane (CAS 5405-17-4), with molecular formula C23H41NO and molecular weight 347.31882 g/mol. IUPAC: (1S,3aS,3bR,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-1-(3-methylbutoxy)-2,3,3a,3b,4,5,5a,6,7,8,9,9b,10,11-tetradecahydro-1H-indeno[5,4-f]quinoline.

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