BAS 00411345
TL;DR: BAS 00411345 (CAS 331443-75-5) is a chemical compound with molecular formula C16H14N4O3S4 and molecular weight 437.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]-2-thiophen-2-ylacetamide
Also Known As: BAS 00411345, N-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)carbamothioyl)-2-(thiophen-2-yl)acetamide, N-(1,3-thiazol-2-yl)-4-({[(2-thienylacetyl)amino]carbothioyl}amino)benzenesulfonamide, N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]-2-thiophen-2-ylacetamide, N-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl}-2-(thiophen-2-yl)acetamide
| Molecular Formula | C16H14N4O3S4 |
|---|---|
| Molecular Weight | 437.99 g/mol |
| LogP | 3.0611 |
| Topological Polar Surface Area | 100.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.99487 |
| Heavy Atoms | 27 |
| Complexity | 1014.3269 |
Chemical Identifiers
| CAS Number | 331443-75-5 |
|---|---|
| SMILES | C1=CSC(=C1)CC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3 |
Product Overview
BAS 00411345 (CAS 331443-75-5), with molecular formula C16H14N4O3S4 and molecular weight 437.99 g/mol. IUPAC: N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]-2-thiophen-2-ylacetamide.
Chemical Property Profile of BAS 00411345
Property Insights of BAS 00411345
The XLogP value of 3.0611 indicates that BAS 00411345 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00411345. Following Lipinski's Rule of Five, BAS 00411345 has 3 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 BAS 00411345?
The CAS number of BAS 00411345 is 331443-75-5.
What is the molecular formula of BAS 00411345?
The molecular formula of BAS 00411345 is C16H14N4O3S4.
What is the molecular weight of BAS 00411345?
The molecular weight of BAS 00411345 is 437.99 g/mol.
Where can I buy BAS 00411345?
You can request a quote for BAS 00411345 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00411345?
Yes, KEHONG BIO provides custom synthesis services for BAS 00411345 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.