2-DemethylColchicine-d3
TL;DR: 2-DemethylColchicine-d3 (CAS 7336-36-9) is a chemical compound with molecular formula C21H23NO6 and molecular weight 385.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-hydroxy-1,3,10-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
Also Known As: 2-Demethyl Colchicine, Isocolchiceine, 2-Demethylcolchicine, 2-DemethylColchicine-d3, O(sup 2)-Demethylcolchicine
| Molecular Formula | C21H23NO6 |
|---|---|
| Molecular Weight | 385.15 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.15253 |
| Heavy Atoms | 28 |
| Complexity | 724.0 |
Chemical Identifiers
| CAS Number | 7336-36-9 |
|---|---|
| SMILES | CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)O)OC |
| InChIKey | DPOVAJCRYIUTBD-UHFFFAOYSA-N |
Product Overview
2-DemethylColchicine-d3 (CAS 7336-36-9), with molecular formula C21H23NO6 and molecular weight 385.15 g/mol. IUPAC: N-(2-hydroxy-1,3,10-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide.
Chemical Property Profile of 2-DemethylColchicine-d3
Property Insights of 2-DemethylColchicine-d3
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-DemethylColchicine-d3. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-DemethylColchicine-d3. Following Lipinski's Rule of Five, 2-DemethylColchicine-d3 has 2 hydrogen bond donor(s) and 6 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-DemethylColchicine-d3?
The CAS number of 2-DemethylColchicine-d3 is 7336-36-9.
What is the molecular formula of 2-DemethylColchicine-d3?
The molecular formula of 2-DemethylColchicine-d3 is C21H23NO6.
What is the molecular weight of 2-DemethylColchicine-d3?
The molecular weight of 2-DemethylColchicine-d3 is 385.15 g/mol.
Where can I buy 2-DemethylColchicine-d3?
You can request a quote for 2-DemethylColchicine-d3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-DemethylColchicine-d3?
Yes, KEHONG BIO provides custom synthesis services for 2-DemethylColchicine-d3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.