2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
TL;DR: 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide (CAS 701239-34-1) is a chemical compound with molecular formula C23H17ClN4O3S2 and molecular weight 496.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide, 2-chloro-N-[5-({2-oxo-2-[(4-phenoxyphenyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, 2-chloro-N-[5-[(4-phenoxyphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide, 2-{5-[(2-chlorophenyl)carbonylamino](1,3,4-thiadiazol-2-ylthio)}-N-(4-phenoxyp henyl)acetamide, 2-CHLORO-N-[5-({[(4-PHENOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]BENZAMIDE
| Molecular Formula | C23H17ClN4O3S2 |
|---|---|
| Molecular Weight | 496.04 g/mol |
| LogP | 5.9669 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 496.04306 |
| Heavy Atoms | 33 |
| Complexity | 1250.0734 |
Chemical Identifiers
| CAS Number | 701239-34-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NN=C(S3)NC(=O)C4=CC=CC=C4Cl |
Product Overview
2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide (CAS 701239-34-1), with molecular formula C23H17ClN4O3S2 and molecular weight 496.04 g/mol. IUPAC: 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Property Insights of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
The XLogP value of 5.9669 indicates that 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide. Following Lipinski's Rule of Five, 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide?
The CAS number of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide is 701239-34-1.
What is the molecular formula of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide?
The molecular formula of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide is C23H17ClN4O3S2.
What is the molecular weight of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide?
The molecular weight of 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide is 496.04 g/mol.
Where can I buy 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide?
You can request a quote for 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[5-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.