4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one
TL;DR: 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one (CAS 16622-18-7) is a chemical compound with molecular formula C20H31NO2 and molecular weight 317.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3aS,3bR,9aR,9bS,11aS)-1-hydroxy-1,6,9a,11a-tetramethyl-2,3,3a,3b,4,8,9,9b,10,11-decahydroindeno[5,4-f]quinolin-7-one
Also Known As: 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one, J2.793.256H, 17beta-Hydroxy-4,17-dimethyl-4-azaandrost-5-en-3-one, A-hydroxy-4,17-dimethyl-4-azaandrost-5-en-3-one, 17beta-Hydroxy-4,17-dimethyl-4-azaandrosta-5-ene-3-one
| Molecular Formula | C20H31NO2 |
|---|---|
| Molecular Weight | 317.24 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 317.23547 |
| Heavy Atoms | 23 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 16622-18-7 |
|---|---|
| SMILES | C[C@]12CCC(=O)N(C1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)C |
| InChIKey | PWVLZAWWMIOCEB-BAUWWDCUSA-N |
Product Overview
4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one (CAS 16622-18-7), with molecular formula C20H31NO2 and molecular weight 317.24 g/mol. IUPAC: (1S,3aS,3bR,9aR,9bS,11aS)-1-hydroxy-1,6,9a,11a-tetramethyl-2,3,3a,3b,4,8,9,9b,10,11-decahydroindeno[5,4-f]quinolin-7-one.
Chemical Property Profile of 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one
Property Insights of 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one
The XLogP value of 3.0 indicates that 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one has 1 hydrogen bond donor(s) and 2 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 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one?
The CAS number of 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one is 16622-18-7.
What is the molecular formula of 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one?
The molecular formula of 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one is C20H31NO2.
What is the molecular weight of 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one?
The molecular weight of 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one is 317.24 g/mol.
Where can I buy 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one?
You can request a quote for 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4,17alpha-Dimethyl-4-aza-5-androsten-17beta-ol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.