Artavenustine
TL;DR: Artavenustine (CAS 88668-27-3) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(13aS)-2-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-3,10,11-triol
Also Known As: Artavenustine, (13aS)-2-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-3,10,11-triol, 6H-Dibenzo(a,g)quinolizine-3,10,11-triol, 5,8,13,13a-tetrahydro-2-methoxy-, (13aS)-, 6H-Dibenzo(a,g)quinolizine-3,10,11-triol, 5,8,13,13a-tetrahydro-2-methoxy-, (S)-, (13aS)-2-Methoxy-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-3,10,11-triol
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 88668-27-3 |
|---|---|
| SMILES | COC1=C(C=C2CCN3CC4=CC(=C(C=C4C[C@H]3C2=C1)O)O)O |
| InChIKey | JBRMCLMXSZKCKB-AWEZNQCLSA-N |
Product Overview
Artavenustine (CAS 88668-27-3), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: (13aS)-2-methoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-3,10,11-triol.
Chemical Property Profile of Artavenustine
Property Insights of Artavenustine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Artavenustine. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Artavenustine. Following Lipinski's Rule of Five, Artavenustine has 3 hydrogen bond donor(s) and 5 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 Artavenustine?
The CAS number of Artavenustine is 88668-27-3.
What is the molecular formula of Artavenustine?
The molecular formula of Artavenustine is C18H19NO4.
What is the molecular weight of Artavenustine?
The molecular weight of Artavenustine is 313.13 g/mol.
Where can I buy Artavenustine?
You can request a quote for Artavenustine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Artavenustine?
Yes, KEHONG BIO provides custom synthesis services for Artavenustine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.