5-Pregnen-3|A,16|A,20|A-triol
TL;DR: 5-Pregnen-3|A,16|A,20|A-triol (CAS 3885-13-0) 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.
17-(1-hydroxyethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
Also Known As: 5-Pregnen-3, A,16, A,20, A-triol, 5-PREGNEN-3-BETA,16-ALPHA,20-ALPHA-TRIOL
| Molecular Formula | C21H34O3 |
|---|---|
| Molecular Weight | 334.25 g/mol |
| LogP | 3.2779 |
| Topological Polar Surface Area | 60.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 334.2508 |
| Heavy Atoms | 24 |
| Complexity | 541.20197 |
Chemical Identifiers
| CAS Number | 3885-13-0 |
|---|---|
| SMILES | CC(C1C(CC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)O)O |
Product Overview
5-Pregnen-3|A,16|A,20|A-triol (CAS 3885-13-0), with molecular formula C21H34O3 and molecular weight 334.25 g/mol. IUPAC: 17-(1-hydroxyethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol.
Chemical Property Profile of 5-Pregnen-3|A,16|A,20|A-triol
Property Insights of 5-Pregnen-3|A,16|A,20|A-triol
The XLogP value of 3.2779 indicates that 5-Pregnen-3|A,16|A,20|A-triol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Pregnen-3|A,16|A,20|A-triol. Following Lipinski's Rule of Five, 5-Pregnen-3|A,16|A,20|A-triol has 3 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-Pregnen-3|A,16|A,20|A-triol?
The CAS number of 5-Pregnen-3|A,16|A,20|A-triol is 3885-13-0.
What is the molecular formula of 5-Pregnen-3|A,16|A,20|A-triol?
The molecular formula of 5-Pregnen-3|A,16|A,20|A-triol is C21H34O3.
What is the molecular weight of 5-Pregnen-3|A,16|A,20|A-triol?
The molecular weight of 5-Pregnen-3|A,16|A,20|A-triol is 334.25 g/mol.
Where can I buy 5-Pregnen-3|A,16|A,20|A-triol?
You can request a quote for 5-Pregnen-3|A,16|A,20|A-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Pregnen-3|A,16|A,20|A-triol?
Yes, KEHONG BIO provides custom synthesis services for 5-Pregnen-3|A,16|A,20|A-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.