RefChem:449418
TL;DR: RefChem:449418 (CAS 538336-36-6) is a chemical compound with molecular formula C26H24Cl2N4OS and molecular weight 510.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2,4-dichlorophenyl)-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-propan-2-ylacetamide
Also Known As: A3032/0127914, 2-{[5-(2,4-DICHLOROPHENYL)-4-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}-N-ISOPROPYL-N-PHENYLACETAMIDE, 2-((5-(2,4-Dichlorophenyl)-4-(o-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-isopropyl-N-phenylacetamide, 2-((5-(2,4-Dichlorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-YL)sulfanyl)-N-isopropyl-N-phenylacetamide, 2-[[5-(2,4-dichlorophenyl)-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-propan-2-ylacetamide
| Molecular Formula | C26H24Cl2N4OS |
|---|---|
| Molecular Weight | 510.10 g/mol |
| LogP | 7.08322 |
| Topological Polar Surface Area | 51.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 510.1048 |
| Heavy Atoms | 34 |
| Complexity | 1307.4158 |
Chemical Identifiers
| CAS Number | 538336-36-6 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=NN=C2SCC(=O)N(C3=CC=CC=C3)C(C)C)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
RefChem:449418 (CAS 538336-36-6), with molecular formula C26H24Cl2N4OS and molecular weight 510.10 g/mol. IUPAC: 2-[[5-(2,4-dichlorophenyl)-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-propan-2-ylacetamide.
Chemical Property Profile of RefChem:449418
Property Insights of RefChem:449418
The XLogP value of 7.08322 indicates that RefChem:449418 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.02 Ų, RefChem:449418 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:449418 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 RefChem:449418?
The CAS number of RefChem:449418 is 538336-36-6.
What is the molecular formula of RefChem:449418?
The molecular formula of RefChem:449418 is C26H24Cl2N4OS.
What is the molecular weight of RefChem:449418?
The molecular weight of RefChem:449418 is 510.10 g/mol.
Where can I buy RefChem:449418?
You can request a quote for RefChem:449418 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:449418?
Yes, KEHONG BIO provides custom synthesis services for RefChem:449418 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.