3-Hydroxy-16-(hydroxymethyl)androstan-17-one
TL;DR: 3-Hydroxy-16-(hydroxymethyl)androstan-17-one (CAS 87782-05-6) is a chemical compound with molecular formula C20H32O3 and molecular weight 320.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-16-(hydroxymethyl)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
Also Known As: NCIOpen2_008409, 3-hydroxy-16-(hydroxymethyl)androstan-17-one, 3-hydroxy-16-(hydroxymethyl)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
| Molecular Formula | C20H32O3 |
|---|---|
| Molecular Weight | 320.24 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.23514 |
| Heavy Atoms | 23 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 87782-05-6 |
|---|---|
| SMILES | CC12CCC(CC1CCC3C2CCC4(C3CC(C4=O)CO)C)O |
| InChIKey | KQHKUOHLCRQQSG-UHFFFAOYSA-N |
Product Overview
3-Hydroxy-16-(hydroxymethyl)androstan-17-one (CAS 87782-05-6), with molecular formula C20H32O3 and molecular weight 320.24 g/mol. IUPAC: 3-hydroxy-16-(hydroxymethyl)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one.
Chemical Property Profile of 3-Hydroxy-16-(hydroxymethyl)androstan-17-one
Property Insights of 3-Hydroxy-16-(hydroxymethyl)androstan-17-one
The XLogP value of 3.6 indicates that 3-Hydroxy-16-(hydroxymethyl)androstan-17-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 3-Hydroxy-16-(hydroxymethyl)androstan-17-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-16-(hydroxymethyl)androstan-17-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 3-Hydroxy-16-(hydroxymethyl)androstan-17-one?
The CAS number of 3-Hydroxy-16-(hydroxymethyl)androstan-17-one is 87782-05-6.
What is the molecular formula of 3-Hydroxy-16-(hydroxymethyl)androstan-17-one?
The molecular formula of 3-Hydroxy-16-(hydroxymethyl)androstan-17-one is C20H32O3.
What is the molecular weight of 3-Hydroxy-16-(hydroxymethyl)androstan-17-one?
The molecular weight of 3-Hydroxy-16-(hydroxymethyl)androstan-17-one is 320.24 g/mol.
Where can I buy 3-Hydroxy-16-(hydroxymethyl)androstan-17-one?
You can request a quote for 3-Hydroxy-16-(hydroxymethyl)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-Hydroxy-16-(hydroxymethyl)androstan-17-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-16-(hydroxymethyl)androstan-17-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.