依托孕烯
TL;DR: 依托孕烯 (CAS 54024-10-1) is a chemical compound with molecular formula C22H28O2 and molecular weight 324.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
依托孕烯
(8S,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-11-methylidene-2,6,7,8,9,10,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: ETONOGESTREL, Implanon, 3-Oxodesogestrel, nexplanon, 3-Ketodesogestrel
| Molecular Formula | C22H28O2 |
|---|---|
| Molecular Weight | 324.21 g/mol |
| LogP | 4.0487 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 324.20892 |
| Heavy Atoms | 24 |
| Complexity | 665.94763 |
Chemical Identifiers
| CAS Number | 54024-10-1 |
|---|---|
| SMILES | CC[C@]12CC(=C)[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34 |
Product Overview
依托孕烯 (CAS 54024-10-1), with molecular formula C22H28O2 and molecular weight 324.21 g/mol. IUPAC: (8S,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-11-methylidene-2,6,7,8,9,10,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 依托孕烯
Property Insights of 依托孕烯
The XLogP value of 4.0487 indicates that 依托孕烯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 依托孕烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 依托孕烯 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 依托孕烯?
The CAS number of 依托孕烯 is 54024-10-1.
What is the molecular formula of 依托孕烯?
The molecular formula of 依托孕烯 is C22H28O2.
What is the molecular weight of 依托孕烯?
The molecular weight of 依托孕烯 is 324.21 g/mol.
Where can I buy 依托孕烯?
You can request a quote for 依托孕烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 依托孕烯?
Yes, KEHONG BIO provides custom synthesis services for 依托孕烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.