AB00668465-01
TL;DR: AB00668465-01 (CAS 534559-49-4) is a chemical compound with molecular formula C12H9F3N4O4S2 and molecular weight 394.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]acetamide
Also Known As: AB00668465-01, N-(1,3-thiazol-2-yl)-4-({[(trifluoroacetyl)amino]carbonyl}amino)benzenesulfonamide, AP-906/42709335, 1-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}-3-(2,2,2-trifluoroacetyl)urea, 2,2,2-trifluoro-N-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)carbamoyl)acetamide
| Molecular Formula | C12H9F3N4O4S2 |
|---|---|
| Molecular Weight | 394.00 g/mol |
| LogP | 2.1543 |
| Topological Polar Surface Area | 117.26 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.00174 |
| Heavy Atoms | 25 |
| Complexity | 864.76526 |
Chemical Identifiers
| CAS Number | 534559-49-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NC(=O)C(F)(F)F)S(=O)(=O)NC2=NC=CS2 |
Product Overview
AB00668465-01 (CAS 534559-49-4), with molecular formula C12H9F3N4O4S2 and molecular weight 394.00 g/mol. IUPAC: 2,2,2-trifluoro-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]acetamide.
Chemical Property Profile of AB00668465-01
Property Insights of AB00668465-01
The XLogP value of 2.1543 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00668465-01. The TPSA of 117.26 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668465-01. Following Lipinski's Rule of Five, AB00668465-01 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 AB00668465-01?
The CAS number of AB00668465-01 is 534559-49-4.
What is the molecular formula of AB00668465-01?
The molecular formula of AB00668465-01 is C12H9F3N4O4S2.
What is the molecular weight of AB00668465-01?
The molecular weight of AB00668465-01 is 394.00 g/mol.
Where can I buy AB00668465-01?
You can request a quote for AB00668465-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668465-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668465-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.