ChemDiv1_003319
TL;DR: ChemDiv1_003319 (CAS 361472-89-1) is a chemical compound with molecular formula C19H18ClN3O3S3 and molecular weight 467.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfanyl-N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: ChemDiv1_003319, 2-[(4-chlorophenyl)thio]-N-(5-{2-[(4-methylphenyl)sulfonyl]ethyl}-1,3,4-thiadiazol-2-yl)acetamide, 2-(4-chlorophenyl)sulfanyl-N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C19H18ClN3O3S3 |
|---|---|
| Molecular Weight | 467.02 g/mol |
| LogP | 4.24712 |
| Topological Polar Surface Area | 89.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 467.0199 |
| Heavy Atoms | 29 |
| Complexity | 1081.8921 |
Chemical Identifiers
| CAS Number | 361472-89-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CCC2=NN=C(S2)NC(=O)CSC3=CC=C(C=C3)Cl |
Product Overview
ChemDiv1_003319 (CAS 361472-89-1), with molecular formula C19H18ClN3O3S3 and molecular weight 467.02 g/mol. IUPAC: 2-(4-chlorophenyl)sulfanyl-N-[5-[2-(4-methylphenyl)sulfonylethyl]-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of ChemDiv1_003319
Property Insights of ChemDiv1_003319
The XLogP value of 4.24712 indicates that ChemDiv1_003319 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.02 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003319. Following Lipinski's Rule of Five, ChemDiv1_003319 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 ChemDiv1_003319?
The CAS number of ChemDiv1_003319 is 361472-89-1.
What is the molecular formula of ChemDiv1_003319?
The molecular formula of ChemDiv1_003319 is C19H18ClN3O3S3.
What is the molecular weight of ChemDiv1_003319?
The molecular weight of ChemDiv1_003319 is 467.02 g/mol.
Where can I buy ChemDiv1_003319?
You can request a quote for ChemDiv1_003319 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003319?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003319 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.