RefChem:249344
TL;DR: RefChem:249344 (CAS 849032-52-6) is a chemical compound with molecular formula C22H20N4O2S and molecular weight 404.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide
Also Known As: 2-[[4-(2-Furanylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]-N-(3-methylphenyl)acetamide, 2-{[4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide, 2-((4-(2-Furanylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(3-methylphenyl)acetamide, 2-((4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(m-tolyl)acetamide, 2-({4-[(Furan-2-yl)methyl]-5-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
| Molecular Formula | C22H20N4O2S |
|---|---|
| Molecular Weight | 404.13 g/mol |
| LogP | 4.62562 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 404.1307 |
| Heavy Atoms | 29 |
| Complexity | 1091.2249 |
Chemical Identifiers
| CAS Number | 849032-52-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4 |
Product Overview
RefChem:249344 (CAS 849032-52-6), with molecular formula C22H20N4O2S and molecular weight 404.13 g/mol. IUPAC: 2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide.
Chemical Property Profile of RefChem:249344
Property Insights of RefChem:249344
The XLogP value of 4.62562 indicates that RefChem:249344 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.95 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:249344. Following Lipinski's Rule of Five, RefChem:249344 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:249344?
The CAS number of RefChem:249344 is 849032-52-6.
What is the molecular formula of RefChem:249344?
The molecular formula of RefChem:249344 is C22H20N4O2S.
What is the molecular weight of RefChem:249344?
The molecular weight of RefChem:249344 is 404.13 g/mol.
Where can I buy RefChem:249344?
You can request a quote for RefChem:249344 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:249344?
Yes, KEHONG BIO provides custom synthesis services for RefChem:249344 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.