![1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea structure](/static/products/488/488102-61-0.png)
1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea
TL;DR: 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea (CAS 488102-61-0) is a chemical compound with molecular formula C16H12Cl2N4OS2 and molecular weight 409.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[5-[(4-chlorophenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea
Also Known As: 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea, 1-(4-chlorophenyl)-3-(5-(((4-chlorophenyl)thio)methyl)-1,3,4-thiadiazol-2-yl)urea, 1-(4-chlorophenyl)-3-[5-[(4-chlorophenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea, 1-(4-chlorophenyl)-3-[(2Z)-5-{[(4-chlorophenyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
| Molecular Formula | C16H12Cl2N4OS2 |
|---|---|
| Molecular Weight | 409.98 g/mol |
| LogP | 5.7812 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.98297 |
| Heavy Atoms | 25 |
| Complexity | 853.3311 |
Chemical Identifiers
| CAS Number | 488102-61-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NC2=NN=C(S2)CSC3=CC=C(C=C3)Cl)Cl |
Product Overview
1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea (CAS 488102-61-0), with molecular formula C16H12Cl2N4OS2 and molecular weight 409.98 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[5-[(4-chlorophenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]urea.
Chemical Property Profile of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea
Property Insights of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea
The XLogP value of 5.7812 indicates that 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea. Following Lipinski's Rule of Five, 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea?
The CAS number of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea is 488102-61-0.
What is the molecular formula of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea?
The molecular formula of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea is C16H12Cl2N4OS2.
What is the molecular weight of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea?
The molecular weight of 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea is 409.98 g/mol.
Where can I buy 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea?
You can request a quote for 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloro-phenyl)-3-[5-(4-chloro-phenylsulfanylmethyl)-[1,3,4]thiadiazol-2-yl]-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.