Coccuvine
TL;DR: Coccuvine (CAS 61445-80-5) is a chemical compound with molecular formula C17H19NO2 and molecular weight 269.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,13bS)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-12-ol
Also Known As: Coccuvine, (2R,13bS)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-12-ol, 3alpha-Methoxy-1,2,6,7-tetradehydroerythrinan-15-ol, Erythrinan-15-ol, 1,2,6,7-tetradehydro-3-methoxy-, (3beta)-, (2R,13bS)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo(7a,1-a)isoquinolin-12-ol
| Molecular Formula | C17H19NO2 |
|---|---|
| Molecular Weight | 269.14 g/mol |
| LogP | 2.3605 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.14157 |
| Heavy Atoms | 20 |
| Complexity | 619.4161 |
Chemical Identifiers
| CAS Number | 61445-80-5 |
|---|---|
| SMILES | CO[C@@H]1C[C@@]23C(=CCN2CCC4=C3C=C(C=C4)O)C=C1 |
Product Overview
Coccuvine (CAS 61445-80-5), with molecular formula C17H19NO2 and molecular weight 269.14 g/mol. IUPAC: (2R,13bS)-2-methoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-12-ol.
Chemical Property Profile of Coccuvine
Property Insights of Coccuvine
The XLogP value of 2.3605 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Coccuvine. With a topological polar surface area (TPSA) of 32.7 Ų, Coccuvine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Coccuvine has 1 hydrogen bond donor(s) and 3 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 Coccuvine?
The CAS number of Coccuvine is 61445-80-5.
What is the molecular formula of Coccuvine?
The molecular formula of Coccuvine is C17H19NO2.
What is the molecular weight of Coccuvine?
The molecular weight of Coccuvine is 269.14 g/mol.
Where can I buy Coccuvine?
You can request a quote for Coccuvine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Coccuvine?
Yes, KEHONG BIO provides custom synthesis services for Coccuvine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.