2-Demethylcolchiceine
TL;DR: 2-Demethylcolchiceine (CAS 33530-04-0) is a chemical compound with molecular formula C20H21NO6 and molecular weight 371.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(7S)-2,10-dihydroxy-1,3-dimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
Also Known As: 2-Demethylcolchiceine, Colchiceine analog, 2,10-Didemethylcolchicine, Acetamide, N-(5,6,7,9-tetrahydro-2,10-dihydroxy-1,3-dimethoxy-9-oxobenzo(a)heptalen-7-yl)-, (S)-, N-[(7S)-2,10-dihydroxy-1,3-dimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
| Molecular Formula | C20H21NO6 |
|---|---|
| Molecular Weight | 371.14 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.1369 |
| Heavy Atoms | 27 |
| Complexity | 709.0 |
Chemical Identifiers
| CAS Number | 33530-04-0 |
|---|---|
| SMILES | CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)O)OC)O)OC |
| InChIKey | VHIVSZXYLQFNPC-AWEZNQCLSA-N |
Product Overview
2-Demethylcolchiceine (CAS 33530-04-0), with molecular formula C20H21NO6 and molecular weight 371.14 g/mol. IUPAC: N-[(7S)-2,10-dihydroxy-1,3-dimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide.
Chemical Property Profile of 2-Demethylcolchiceine
Property Insights of 2-Demethylcolchiceine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Demethylcolchiceine. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Demethylcolchiceine. Following Lipinski's Rule of Five, 2-Demethylcolchiceine has 3 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-Demethylcolchiceine?
The CAS number of 2-Demethylcolchiceine is 33530-04-0.
What is the molecular formula of 2-Demethylcolchiceine?
The molecular formula of 2-Demethylcolchiceine is C20H21NO6.
What is the molecular weight of 2-Demethylcolchiceine?
The molecular weight of 2-Demethylcolchiceine is 371.14 g/mol.
Where can I buy 2-Demethylcolchiceine?
You can request a quote for 2-Demethylcolchiceine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Demethylcolchiceine?
Yes, KEHONG BIO provides custom synthesis services for 2-Demethylcolchiceine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.