Estr-8(14)-en-3-one, (5alpha)-
TL;DR: Estr-8(14)-en-3-one, (5alpha)- (CAS 13244-19-4) is a chemical compound with molecular formula C18H26O and molecular weight 258.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S,9R,10S,13S)-13-methyl-2,4,5,6,7,9,10,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 5alpha-Ostr-8(14)en-3-one, Estr-8(14)-en-3-one, Estr-8(14)-en-3-one, (5alpha)-, (5, A)-estr-8(14)-en-3-one
| Molecular Formula | C18H26O |
|---|---|
| Molecular Weight | 258.20 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 258.19836 |
| Heavy Atoms | 19 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 13244-19-4 |
|---|---|
| SMILES | C[C@@]12CCCC1=C3CC[C@H]4CC(=O)CC[C@@H]4[C@H]3CC2 |
| InChIKey | AQZOMKUJZMRYEG-FRQROOTJSA-N |
Product Overview
Estr-8(14)-en-3-one, (5alpha)- (CAS 13244-19-4), with molecular formula C18H26O and molecular weight 258.20 g/mol. IUPAC: (5S,9R,10S,13S)-13-methyl-2,4,5,6,7,9,10,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Estr-8(14)-en-3-one, (5alpha)-
Property Insights of Estr-8(14)-en-3-one, (5alpha)-
The XLogP value of 3.7 indicates that Estr-8(14)-en-3-one, (5alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Estr-8(14)-en-3-one, (5alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Estr-8(14)-en-3-one, (5alpha)- has 0 hydrogen bond donor(s) and 1 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 Estr-8(14)-en-3-one, (5alpha)-?
The CAS number of Estr-8(14)-en-3-one, (5alpha)- is 13244-19-4.
What is the molecular formula of Estr-8(14)-en-3-one, (5alpha)-?
The molecular formula of Estr-8(14)-en-3-one, (5alpha)- is C18H26O.
What is the molecular weight of Estr-8(14)-en-3-one, (5alpha)-?
The molecular weight of Estr-8(14)-en-3-one, (5alpha)- is 258.20 g/mol.
Where can I buy Estr-8(14)-en-3-one, (5alpha)-?
You can request a quote for Estr-8(14)-en-3-one, (5alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Estr-8(14)-en-3-one, (5alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Estr-8(14)-en-3-one, (5alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.