Einecs 227-699-7
TL;DR: Einecs 227-699-7 (CAS 5941-92-4) is a chemical compound with molecular formula C20H24O2 and molecular weight 296.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(13S,14S)-13-ethyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
Also Known As: KST-1A6496, (1)-13-Ethyl-3-methoxygona-1,3,5(10),8-tetraen-17-one, 13-Ethyl-3-methoxygona-1,3,5(10),8-tetraen-17-one, 13beta-Ethyl-3-methoxygona-1,3,5(10),8-tetraen-17-one, (+-)-13-ethyl-3-methoxygona-1,3,5(10),8-tetraen-17-one
| Molecular Formula | C20H24O2 |
|---|---|
| Molecular Weight | 296.18 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.17764 |
| Heavy Atoms | 22 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 5941-92-4 |
|---|---|
| SMILES | CC[C@]12CCC3=C([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)OC |
| InChIKey | PFKPABPFEUSONI-ICSRJNTNSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Einecs 227-699-7 (CAS 5941-92-4), with molecular formula C20H24O2 and molecular weight 296.18 g/mol. IUPAC: (13S,14S)-13-ethyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one.
Chemical Property Profile of Einecs 227-699-7
Property Insights of Einecs 227-699-7
The XLogP value of 3.1 indicates that Einecs 227-699-7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Einecs 227-699-7 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Einecs 227-699-7 has 0 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 Einecs 227-699-7?
The CAS number of Einecs 227-699-7 is 5941-92-4.
What is the molecular formula of Einecs 227-699-7?
The molecular formula of Einecs 227-699-7 is C20H24O2.
What is the molecular weight of Einecs 227-699-7?
The molecular weight of Einecs 227-699-7 is 296.18 g/mol.
Where can I buy Einecs 227-699-7?
You can request a quote for Einecs 227-699-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 227-699-7?
Yes, KEHONG BIO provides custom synthesis services for Einecs 227-699-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.