3H-383S
TL;DR: 3H-383S (CAS 338408-92-7) is a chemical compound with molecular formula C17H11Cl2F3N4O and molecular weight 414.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dichlorophenyl)-5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide
Also Known As: 3H-383S, 1-(3,5-dichlorophenyl)-5-methyl-N-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-3-carboxamide, 1-(3,5-dichlorophenyl)-5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide, 1H-1,2,4-Triazole-3-carboxamide, 1-(3,5-dichlorophenyl)-5-methyl-N-[2-(trifluoromethyl)phenyl]-
| Molecular Formula | C17H11Cl2F3N4O |
|---|---|
| Molecular Weight | 414.03 g/mol |
| LogP | 5.15362 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.0262 |
| Heavy Atoms | 27 |
| Complexity | 997.4034 |
Chemical Identifiers
| CAS Number | 338408-92-7 |
|---|---|
| SMILES | CC1=NC(=NN1C2=CC(=CC(=C2)Cl)Cl)C(=O)NC3=CC=CC=C3C(F)(F)F |
Product Overview
3H-383S (CAS 338408-92-7), with molecular formula C17H11Cl2F3N4O and molecular weight 414.03 g/mol. IUPAC: 1-(3,5-dichlorophenyl)-5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxamide.
Chemical Property Profile of 3H-383S
Property Insights of 3H-383S
The XLogP value of 5.15362 indicates that 3H-383S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, 3H-383S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-383S has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3H-383S?
The CAS number of 3H-383S is 338408-92-7.
What is the molecular formula of 3H-383S?
The molecular formula of 3H-383S is C17H11Cl2F3N4O.
What is the molecular weight of 3H-383S?
The molecular weight of 3H-383S is 414.03 g/mol.
Where can I buy 3H-383S?
You can request a quote for 3H-383S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-383S?
Yes, KEHONG BIO provides custom synthesis services for 3H-383S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.