AB01305576-01
TL;DR: AB01305576-01 (CAS 848987-98-4) is a chemical compound with molecular formula C22H18F2N4O2S and molecular weight 440.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: AB01305576-01, N-(3,4-difluorophenyl)-2-{[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(3,4-difluorophenyl)-2-((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(3,4-difluorophenyl)-2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(3,4-difluorophenyl)-2-[4-(2-furylmethyl)-5-(3-methylphenyl)(1,2,4-triazol-3 -ylthio)]acetamide
| Molecular Formula | C22H18F2N4O2S |
|---|---|
| Molecular Weight | 440.11 g/mol |
| LogP | 4.90382 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 440.11185 |
| Heavy Atoms | 31 |
| Complexity | 1208.2086 |
Chemical Identifiers
| CAS Number | 848987-98-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC(=C(C=C4)F)F |
Product Overview
AB01305576-01 (CAS 848987-98-4), with molecular formula C22H18F2N4O2S and molecular weight 440.11 g/mol. IUPAC: N-(3,4-difluorophenyl)-2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of AB01305576-01
Property Insights of AB01305576-01
The XLogP value of 4.90382 indicates that AB01305576-01 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 AB01305576-01. Following Lipinski's Rule of Five, AB01305576-01 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 AB01305576-01?
The CAS number of AB01305576-01 is 848987-98-4.
What is the molecular formula of AB01305576-01?
The molecular formula of AB01305576-01 is C22H18F2N4O2S.
What is the molecular weight of AB01305576-01?
The molecular weight of AB01305576-01 is 440.11 g/mol.
Where can I buy AB01305576-01?
You can request a quote for AB01305576-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01305576-01?
Yes, KEHONG BIO provides custom synthesis services for AB01305576-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.