Colchicine S-Oxide
TL;DR: Colchicine S-Oxide (CAS 76189-03-2) is a chemical compound with molecular formula C22H25NO6S and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,2,3-trimethoxy-10-methylsulfinyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
Also Known As: Colchicine S-Oxide, N-(1,2,3-trimethoxy-10-methylsulfinyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide, N-[10-(Methanesulfinyl)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
| Molecular Formula | C22H25NO6S |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.14026 |
| Heavy Atoms | 30 |
| Complexity | 816.0 |
Chemical Identifiers
| CAS Number | 76189-03-2 |
|---|---|
| SMILES | CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)S(=O)C)OC)OC)OC |
| InChIKey | WPRGBKZCSCXZNE-UHFFFAOYSA-N |
Product Overview
Colchicine S-Oxide (CAS 76189-03-2), with molecular formula C22H25NO6S and molecular weight 431.14 g/mol. IUPAC: N-(1,2,3-trimethoxy-10-methylsulfinyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide.
Chemical Property Profile of Colchicine S-Oxide
Property Insights of Colchicine S-Oxide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Colchicine S-Oxide. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Colchicine S-Oxide. Following Lipinski's Rule of Five, Colchicine S-Oxide has 1 hydrogen bond donor(s) and 7 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 Colchicine S-Oxide?
The CAS number of Colchicine S-Oxide is 76189-03-2.
What is the molecular formula of Colchicine S-Oxide?
The molecular formula of Colchicine S-Oxide is C22H25NO6S.
What is the molecular weight of Colchicine S-Oxide?
The molecular weight of Colchicine S-Oxide is 431.14 g/mol.
Where can I buy Colchicine S-Oxide?
You can request a quote for Colchicine S-Oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Colchicine S-Oxide?
Yes, KEHONG BIO provides custom synthesis services for Colchicine S-Oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.