2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-
TL;DR: 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- (CAS 102323-79-5) is a chemical compound with molecular formula C20H22O2 and molecular weight 294.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aS)-8-methoxy-4a-methyl-3,4,5,6,11,12-hexahydrochrysen-2-one
Also Known As: J1.398.613D, (4aS)-8-methoxy-4a-methyl-3,4,5,6,11,12-hexahydrochrysen-2-one, 17-Methoxy-D-homo-18-norandrosta-4,8,13,15,17-pentene-3-one, (4aS)-8-methoxy-4a-methyl-2,3,4,4a,5,6,11,12-octahydrochrysen-2-one, (4as)-8-methoxy-4a-methyl-4,4a,5,6,11,12-hexahydrochrysen-2(3h)-one
| Molecular Formula | C20H22O2 |
|---|---|
| Molecular Weight | 294.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 294.162 |
| Heavy Atoms | 22 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 102323-79-5 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CCC3=C2CCC4=C3C=CC(=C4)OC |
| InChIKey | LIWPFSRVWYAGHN-FQEVSTJZSA-N |
Product Overview
2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- (CAS 102323-79-5), with molecular formula C20H22O2 and molecular weight 294.16 g/mol. IUPAC: (4aS)-8-methoxy-4a-methyl-3,4,5,6,11,12-hexahydrochrysen-2-one.
Chemical Property Profile of 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-
Property Insights of 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-. With a topological polar surface area (TPSA) of 26.3 Ų, 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- 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 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-?
The CAS number of 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- is 102323-79-5.
What is the molecular formula of 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-?
The molecular formula of 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- is C20H22O2.
What is the molecular weight of 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-?
The molecular weight of 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- is 294.16 g/mol.
Where can I buy 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-?
You can request a quote for 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Chrysenone, 4,4a,5,6,11,12-hexahydro-8-methoxy-4a-methyl-, (4aS)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.