3,3-(Dimethoxy)-5alpha-androstan-17-one
TL;DR: 3,3-(Dimethoxy)-5alpha-androstan-17-one (CAS 3591-19-3) is a chemical compound with molecular formula C21H34O3 and molecular weight 334.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethoxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one
Also Known As: 3,3-Dimethoxy-5?-androstan-17-one, 3,3-(Dimethoxy)-5alpha-androstan-17-one, 3,3-dimethoxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one
| Molecular Formula | C21H34O3 |
|---|---|
| Molecular Weight | 334.25 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 334.2508 |
| Heavy Atoms | 24 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 3591-19-3 |
|---|---|
| SMILES | CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)(OC)OC |
| InChIKey | LLKUOQXUUFDONQ-UHFFFAOYSA-N |
Product Overview
3,3-(Dimethoxy)-5alpha-androstan-17-one (CAS 3591-19-3), with molecular formula C21H34O3 and molecular weight 334.25 g/mol. IUPAC: 3,3-dimethoxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one.
Chemical Property Profile of 3,3-(Dimethoxy)-5alpha-androstan-17-one
Property Insights of 3,3-(Dimethoxy)-5alpha-androstan-17-one
The XLogP value of 4.0 indicates that 3,3-(Dimethoxy)-5alpha-androstan-17-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 3,3-(Dimethoxy)-5alpha-androstan-17-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-(Dimethoxy)-5alpha-androstan-17-one has 0 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 3,3-(Dimethoxy)-5alpha-androstan-17-one?
The CAS number of 3,3-(Dimethoxy)-5alpha-androstan-17-one is 3591-19-3.
What is the molecular formula of 3,3-(Dimethoxy)-5alpha-androstan-17-one?
The molecular formula of 3,3-(Dimethoxy)-5alpha-androstan-17-one is C21H34O3.
What is the molecular weight of 3,3-(Dimethoxy)-5alpha-androstan-17-one?
The molecular weight of 3,3-(Dimethoxy)-5alpha-androstan-17-one is 334.25 g/mol.
Where can I buy 3,3-(Dimethoxy)-5alpha-androstan-17-one?
You can request a quote for 3,3-(Dimethoxy)-5alpha-androstan-17-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-(Dimethoxy)-5alpha-androstan-17-one?
Yes, KEHONG BIO provides custom synthesis services for 3,3-(Dimethoxy)-5alpha-androstan-17-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.