7H-472S
TL;DR: 7H-472S (CAS 344271-34-7) is a chemical compound with molecular formula C23H18Cl3N3S2 and molecular weight 505.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)methylsulfanyl]-5-[(2,6-dichlorophenyl)methylsulfanylmethyl]-4-phenyl-1,2,4-triazole
Also Known As: 7H-472S, 4-chlorobenzyl 5-{[(2,6-dichlorobenzyl)sulfanyl]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl sulfide, 3-[(4-chlorophenyl)methylsulfanyl]-5-[(2,6-dichlorophenyl)methylsulfanylmethyl]-4-phenyl-1,2,4-triazole, 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-({[(2,6-dichlorophenyl)methyl]sulfanyl}methyl)-4-phenyl-4H-1,2,4-triazole
| Molecular Formula | C23H18Cl3N3S2 |
|---|---|
| Molecular Weight | 505.00 g/mol |
| LogP | 7.9532 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 505.00076 |
| Heavy Atoms | 31 |
| Complexity | 1128.4578 |
Chemical Identifiers
| CAS Number | 344271-34-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)CSCC4=C(C=CC=C4Cl)Cl |
Product Overview
7H-472S (CAS 344271-34-7), with molecular formula C23H18Cl3N3S2 and molecular weight 505.00 g/mol. IUPAC: 3-[(4-chlorophenyl)methylsulfanyl]-5-[(2,6-dichlorophenyl)methylsulfanylmethyl]-4-phenyl-1,2,4-triazole.
Chemical Property Profile of 7H-472S
Property Insights of 7H-472S
The XLogP value of 7.9532 indicates that 7H-472S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, 7H-472S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7H-472S has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7H-472S?
The CAS number of 7H-472S is 344271-34-7.
What is the molecular formula of 7H-472S?
The molecular formula of 7H-472S is C23H18Cl3N3S2.
What is the molecular weight of 7H-472S?
The molecular weight of 7H-472S is 505.00 g/mol.
Where can I buy 7H-472S?
You can request a quote for 7H-472S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7H-472S?
Yes, KEHONG BIO provides custom synthesis services for 7H-472S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.