![2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide structure](/static/products/859/859471-95-7.png)
2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide
TL;DR: 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide (CAS 859471-95-7) is a chemical compound with molecular formula C35H29Cl2N5OS2 and molecular weight 669.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(5-chloro-2-methylphenyl)-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(3,3-diphenylpropyl)-1,3-thiazole-4-carboxamide
Also Known As: 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide, 2-[[4-(5-chloro-2-methylphenyl)-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(3,3-diphenylpropyl)-1,3-thiazole-4-carboxamide
| Molecular Formula | C35H29Cl2N5OS2 |
|---|---|
| Molecular Weight | 669.12 g/mol |
| LogP | 9.25032 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 669.1191 |
| Heavy Atoms | 45 |
| Complexity | 1870.8297 |
Chemical Identifiers
| CAS Number | 859471-95-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)N2C(=NN=C2SCC3=NC(=CS3)C(=O)NCCC(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6Cl |
Product Overview
2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide (CAS 859471-95-7), with molecular formula C35H29Cl2N5OS2 and molecular weight 669.12 g/mol. IUPAC: 2-[[4-(5-chloro-2-methylphenyl)-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(3,3-diphenylpropyl)-1,3-thiazole-4-carboxamide.
Chemical Property Profile of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide
Property Insights of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide
The XLogP value of 9.25032 indicates that 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide. Following Lipinski's Rule of Five, 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
The CAS number of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is 859471-95-7.
What is the molecular formula of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
The molecular formula of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is C35H29Cl2N5OS2.
What is the molecular weight of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
The molecular weight of 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide is 669.12 g/mol.
Where can I buy 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
You can request a quote for 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[[[4-(5-Chloro-2-methylphenyl)-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-N-(3,3-diphenylpropyl)-4-thiazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.