17,17,17-Trifluorocolchicine
TL;DR: 17,17,17-Trifluorocolchicine (CAS 102491-71-4) is a chemical compound with molecular formula C22H22F3NO6 and molecular weight 453.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-N-(1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide
Also Known As: 17,17,17-Trifluorocolchicine, Colchicine, N-desacetyl-N-TFA-, N-Trifluoroacetyldeacetylcolchicine, COLCHICINE, 17,17,17-TRIFLUORO-, N-Deacetyl-N-(trifluoroacetyl)colchicine
| Molecular Formula | C22H22F3NO6 |
|---|---|
| Molecular Weight | 453.14 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.13992 |
| Heavy Atoms | 32 |
| Complexity | 834.0 |
Chemical Identifiers
| CAS Number | 102491-71-4 |
|---|---|
| SMILES | COC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=O)C(F)(F)F |
| InChIKey | MCHADYPYCJQLMV-UHFFFAOYSA-N |
Product Overview
17,17,17-Trifluorocolchicine (CAS 102491-71-4), with molecular formula C22H22F3NO6 and molecular weight 453.14 g/mol. IUPAC: 2,2,2-trifluoro-N-(1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl)acetamide.
Chemical Property Profile of 17,17,17-Trifluorocolchicine
Property Insights of 17,17,17-Trifluorocolchicine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 17,17,17-Trifluorocolchicine. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 17,17,17-Trifluorocolchicine. Following Lipinski's Rule of Five, 17,17,17-Trifluorocolchicine has 1 hydrogen bond donor(s) and 9 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 17,17,17-Trifluorocolchicine?
The CAS number of 17,17,17-Trifluorocolchicine is 102491-71-4.
What is the molecular formula of 17,17,17-Trifluorocolchicine?
The molecular formula of 17,17,17-Trifluorocolchicine is C22H22F3NO6.
What is the molecular weight of 17,17,17-Trifluorocolchicine?
The molecular weight of 17,17,17-Trifluorocolchicine is 453.14 g/mol.
Where can I buy 17,17,17-Trifluorocolchicine?
You can request a quote for 17,17,17-Trifluorocolchicine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17,17,17-Trifluorocolchicine?
Yes, KEHONG BIO provides custom synthesis services for 17,17,17-Trifluorocolchicine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.