RefChem:97282
TL;DR: RefChem:97282 (CAS 62551-57-9) is a chemical compound with molecular formula C15H11Br2Cl2N3S and molecular weight 492.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-bromo-3-[bromo-(2-chlorophenyl)methyl]thiophen-2-yl]-3-(chloromethyl)-5-methyl-1,2,4-triazole
Also Known As: EINECS 263-589-5, 4-(5-Bromo-3-(bromo(2-chlorophenyl)methyl)-2-thienyl)-3-(chloromethyl)-5-methyl-4H-1,2,4-triazole, 4-(5-Bromo-3-(bromo(2-chlorophenyl)methyl)thiophen-2-yl)-3-(chloromethyl)-5-methyl-4H-1,2,4-triazole, 4-[5-bromo-3-[bromo(2-chlorophenyl)methyl]-2-thienyl]-3-(chloromethyl)-5-methyl-4H-1,2,4-triazole, 4-[5-bromo-3-[bromo-(2-chlorophenyl)methyl]thiophen-2-yl]-3-(chloromethyl)-5-methyl-1,2,4-triazole
| Molecular Formula | C15H11Br2Cl2N3S |
|---|---|
| Molecular Weight | 492.84 g/mol |
| LogP | 6.27622 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 492.84174 |
| Heavy Atoms | 23 |
| Complexity | 847.1171 |
Chemical Identifiers
| CAS Number | 62551-57-9 |
|---|---|
| SMILES | CC1=NN=C(N1C2=C(C=C(S2)Br)C(C3=CC=CC=C3Cl)Br)CCl |
Product Overview
RefChem:97282 (CAS 62551-57-9), with molecular formula C15H11Br2Cl2N3S and molecular weight 492.84 g/mol. IUPAC: 4-[5-bromo-3-[bromo-(2-chlorophenyl)methyl]thiophen-2-yl]-3-(chloromethyl)-5-methyl-1,2,4-triazole.
Chemical Property Profile of RefChem:97282
Property Insights of RefChem:97282
The XLogP value of 6.27622 indicates that RefChem:97282 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, RefChem:97282 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:97282 has 0 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 RefChem:97282?
The CAS number of RefChem:97282 is 62551-57-9.
What is the molecular formula of RefChem:97282?
The molecular formula of RefChem:97282 is C15H11Br2Cl2N3S.
What is the molecular weight of RefChem:97282?
The molecular weight of RefChem:97282 is 492.84 g/mol.
Where can I buy RefChem:97282?
You can request a quote for RefChem:97282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:97282?
Yes, KEHONG BIO provides custom synthesis services for RefChem:97282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.