11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one
TL;DR: 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one (CAS 5888-10-8) is a chemical compound with molecular formula C21H32O3 and molecular weight 332.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,8S,9S,10R,11R,13S,14S,17S)-11,17-dihydroxy-2,10,13,17-tetramethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 1,1-Diethyl-2-sek-hexylhydrazin, 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one, N,N-diethyl-N'-(1-methyl-pentyl)-hydrazine, J2.791.698H, 11,17-Dihydroxy-2,17-dimethylandrost-4-en-3-one
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.24 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 5888-10-8 |
|---|---|
| SMILES | C[C@@H]1C[C@@]2([C@@H]3[C@@H](CCC2=CC1=O)[C@@H]4CC[C@]([C@]4(C[C@H]3O)C)(C)O)C |
| InChIKey | QYTBFAIVLHMSQG-RWWLUNCRSA-N |
Product Overview
11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one (CAS 5888-10-8), with molecular formula C21H32O3 and molecular weight 332.24 g/mol. IUPAC: (2R,8S,9S,10R,11R,13S,14S,17S)-11,17-dihydroxy-2,10,13,17-tetramethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one
Property Insights of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one. With a topological polar surface area (TPSA) of 57.5 Ų, 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one?
The CAS number of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one is 5888-10-8.
What is the molecular formula of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one?
The molecular formula of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one is C21H32O3.
What is the molecular weight of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one?
The molecular weight of 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one is 332.24 g/mol.
Where can I buy 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one?
You can request a quote for 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 11alpha,17beta-Dihydroxy-2alpha,17-dimethylandrost-4-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.