Centatin
TL;DR: Centatin (CAS 104010-41-5) is a chemical compound with molecular formula C21H30O2 and molecular weight 314.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(10R,13S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
Also Known As: Pregnadienolone, Centatin, 16-Dehydropregnenolone, 16,17-Didehydropregnenolone, Pregna-5,16-dien-20-one, 3-hydroxy-, (3b)-
| Molecular Formula | C21H30O2 |
|---|---|
| Molecular Weight | 314.22 g/mol |
| LogP | 4.4354 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.22458 |
| Heavy Atoms | 23 |
| Complexity | 600.9628 |
Chemical Identifiers
| CAS Number | 104010-41-5 |
|---|---|
| SMILES | CC(=O)C1=CCC2[C@@]1(CCC3C2CC=C4[C@@]3(CCC(C4)O)C)C |
Product Overview
Centatin (CAS 104010-41-5), with molecular formula C21H30O2 and molecular weight 314.22 g/mol. IUPAC: 1-[(10R,13S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone.
Chemical Property Profile of Centatin
Property Insights of Centatin
The XLogP value of 4.4354 indicates that Centatin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Centatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Centatin 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 Centatin?
The CAS number of Centatin is 104010-41-5.
What is the molecular formula of Centatin?
The molecular formula of Centatin is C21H30O2.
What is the molecular weight of Centatin?
The molecular weight of Centatin is 314.22 g/mol.
Where can I buy Centatin?
You can request a quote for Centatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Centatin?
Yes, KEHONG BIO provides custom synthesis services for Centatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.