chempirical

Dihydroproscar

C23H38N2O2CAS 98319-24-5374.57 g/mol

Open in Covalent MOL file
ONHONH
AmideLactam

Properties

Molecular formula
C23H38N2O2
Molar mass
374.57 g/mol
Exact mass
374.2933 Da
logP
4.04Crippen estimate
Polar surface area
58.2 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1
Stereocentres
S, S, S, S, S, R, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
98319-24-5
SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)NC(C)(C)C)CC[C@@H]4[C@@]3(CCC(=O)N4)C
InChIKey
ZOIUUCNFVDJSJK-WSBQPABSSA-N
InChI
InChI=1S/C23H38N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h14-18H,6-13H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names
  • (4aR,4bS,6aS,7S,9aS,9bS,11aR)-N-(tert-butyl)-4a,6a-dimethyl-2-oxohexadecahydro-1H-indeno(5,4-f)quinoline-7-carboxamide

Work with Dihydroproscar

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5Alpha-Dihydroprogesterone566-65-441 % similar (4aR,4bS,6aS,7S,9aS,9bS,11aR)-4a,6a-dimethyl-2-oxohexadecahydro-1H-indeno[5,4-f]quinoline-7-carboxylic acid103335-55-340 % similar 3α-Hydroxy-5α-pregnan-20-one516-54-137 % similar Isopregnanolone516-55-237 % similar Dihydrotestosterone521-18-635 % similar Cholestanone26264-62-034 % similar Progesterone57-83-034 % similar (17Beta)-3-Oxoandrost-4-ene-17-carboxylic acid302-97-634 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook