5-Androstene-3,17-diol-17-cyanide
TL;DR: 5-Androstene-3,17-diol-17-cyanide (CAS 35060-03-8) is a chemical compound with molecular formula C20H29NO2 and molecular weight 315.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17-carbonitrile
Also Known As: 5-Androstene-3,17-diol-17-cyanide, 3,17-Dihydroxyandrost-5-ene-17-carbonitrile, 5-Androsten-17.alpha.-cyano-3.beta.,17.beta.-diol, 3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17-carbonitrile, Androst-5-ene-17-carbonitrile, 3,17-dihydroxy-, (3.beta.,17.beta.)-
| Molecular Formula | C20H29NO2 |
|---|---|
| Molecular Weight | 315.22 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 315.21982 |
| Heavy Atoms | 23 |
| Complexity | 604.0 |
Chemical Identifiers
| CAS Number | 35060-03-8 |
|---|---|
| SMILES | CC12CCC(CC1=CCC3C2CCC4(C3CCC4(C#N)O)C)O |
| InChIKey | HMLYKJJOHHAVFP-UHFFFAOYSA-N |
Product Overview
5-Androstene-3,17-diol-17-cyanide (CAS 35060-03-8), with molecular formula C20H29NO2 and molecular weight 315.22 g/mol. IUPAC: 3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17-carbonitrile.
Chemical Property Profile of 5-Androstene-3,17-diol-17-cyanide
Property Insights of 5-Androstene-3,17-diol-17-cyanide
The XLogP value of 3.1 indicates that 5-Androstene-3,17-diol-17-cyanide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Androstene-3,17-diol-17-cyanide. Following Lipinski's Rule of Five, 5-Androstene-3,17-diol-17-cyanide 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 5-Androstene-3,17-diol-17-cyanide?
The CAS number of 5-Androstene-3,17-diol-17-cyanide is 35060-03-8.
What is the molecular formula of 5-Androstene-3,17-diol-17-cyanide?
The molecular formula of 5-Androstene-3,17-diol-17-cyanide is C20H29NO2.
What is the molecular weight of 5-Androstene-3,17-diol-17-cyanide?
The molecular weight of 5-Androstene-3,17-diol-17-cyanide is 315.22 g/mol.
Where can I buy 5-Androstene-3,17-diol-17-cyanide?
You can request a quote for 5-Androstene-3,17-diol-17-cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Androstene-3,17-diol-17-cyanide?
Yes, KEHONG BIO provides custom synthesis services for 5-Androstene-3,17-diol-17-cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.