4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex
TL;DR: 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex (CAS 7463-45-8) is a chemical compound with molecular formula C19H25NO3 and molecular weight 315.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hexahydrophenanthren-3-one
Also Known As: 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex, 4a-Ethenyl-5,6-dimethoxy-10-(methylamino)-1,4,4a,9,10,10a-hexahydrophenanthren-3(2H)-one, 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hexahydrophenanthren-3-one
| Molecular Formula | C19H25NO3 |
|---|---|
| Molecular Weight | 315.18 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.18344 |
| Heavy Atoms | 23 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 7463-45-8 |
|---|---|
| SMILES | CNC1CC2=C(C(=C(C=C2)OC)OC)C3(C1CCC(=O)C3)C=C |
| InChIKey | TVUQQPFSPXDGRX-UHFFFAOYSA-N |
Product Overview
4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex (CAS 7463-45-8), with molecular formula C19H25NO3 and molecular weight 315.18 g/mol. IUPAC: 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hexahydrophenanthren-3-one.
Chemical Property Profile of 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex
Property Insights of 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex. With a topological polar surface area (TPSA) of 47.6 Ų, 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex has 1 hydrogen bond donor(s) and 4 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 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex?
The CAS number of 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex is 7463-45-8.
What is the molecular formula of 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex?
The molecular formula of 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex is C19H25NO3.
What is the molecular weight of 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex?
The molecular weight of 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex is 315.18 g/mol.
Where can I buy 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex?
You can request a quote for 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex?
Yes, KEHONG BIO provides custom synthesis services for 4a-ethenyl-5,6-dimethoxy-10-(methylamino)-1,2,4,9,10,10a-hex and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.