COLUBRINE, BETA
TL;DR: COLUBRINE, BETA (CAS 509-36-4) is a chemical compound with molecular formula C22H24N2O3 and molecular weight 364.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-methoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
Also Known As: COLUBRINE, BETA, methoxy[?]one, 2-Methoxy strychnine, beta-COLUBRINE, 2-Methoxy-strychnine
| Molecular Formula | C22H24N2O3 |
|---|---|
| Molecular Weight | 364.18 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 364.17868 |
| Heavy Atoms | 27 |
| Complexity | 737.0 |
Chemical Identifiers
| CAS Number | 509-36-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N3C4C25CCN6C5CC7C4C(CC3=O)OCC=C7C6 |
| InChIKey | ZTHVHELPCLGXHF-UHFFFAOYSA-N |
Product Overview
COLUBRINE, BETA (CAS 509-36-4), with molecular formula C22H24N2O3 and molecular weight 364.18 g/mol. IUPAC: 10-methoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one.
Chemical Property Profile of COLUBRINE, BETA
Property Insights of COLUBRINE, BETA
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for COLUBRINE, BETA. With a topological polar surface area (TPSA) of 42.0 Ų, COLUBRINE, BETA exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, COLUBRINE, BETA has 0 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 COLUBRINE, BETA?
The CAS number of COLUBRINE, BETA is 509-36-4.
What is the molecular formula of COLUBRINE, BETA?
The molecular formula of COLUBRINE, BETA is C22H24N2O3.
What is the molecular weight of COLUBRINE, BETA?
The molecular weight of COLUBRINE, BETA is 364.18 g/mol.
Where can I buy COLUBRINE, BETA?
You can request a quote for COLUBRINE, BETA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for COLUBRINE, BETA?
Yes, KEHONG BIO provides custom synthesis services for COLUBRINE, BETA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.