3-Methoxygona-1(10),2,4,8,13-pentaen-17-one
TL;DR: 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one (CAS 21070-86-0) is a chemical compound with molecular formula C18H18O2 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-6,7,11,12,15,16-hexahydrocyclopenta[a]phenanthren-17-one
Also Known As: 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one, Gona-1,3,5(10),8,13-pentaen-17-one, 3-methyoxy-, 3-methoxy-6,7,11,12,15,16-hexahydrocyclopenta[a]phenanthren-17-one
| Molecular Formula | C18H18O2 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.13068 |
| Heavy Atoms | 20 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 21070-86-0 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=C(CC2)C4=C(CC3)C(=O)CC4 |
| InChIKey | ZJDQUESRTUGPHS-UHFFFAOYSA-N |
Product Overview
3-Methoxygona-1(10),2,4,8,13-pentaen-17-one (CAS 21070-86-0), with molecular formula C18H18O2 and molecular weight 266.13 g/mol. IUPAC: 3-methoxy-6,7,11,12,15,16-hexahydrocyclopenta[a]phenanthren-17-one.
Chemical Property Profile of 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one
Property Insights of 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one 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 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one?
The CAS number of 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one is 21070-86-0.
What is the molecular formula of 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one?
The molecular formula of 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one is C18H18O2.
What is the molecular weight of 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one?
The molecular weight of 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one is 266.13 g/mol.
Where can I buy 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one?
You can request a quote for 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxygona-1(10),2,4,8,13-pentaen-17-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.