AB01279525-01
TL;DR: AB01279525-01 (CAS 690248-70-5) is a chemical compound with molecular formula C23H21FN4O3S and molecular weight 452.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)propanamide
Also Known As: AB01279525-01, AS-871/43103143, 3-((3-(4-fluorophenyl)-1H-1,2,4-triazol-5-yl)thio)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)propanamide, F1710-0021, 3-{[3-(4-fluorophenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}-N-[(furan-2-yl)methyl]-3-(4-methoxyphenyl)propanamide
| Molecular Formula | C23H21FN4O3S |
|---|---|
| Molecular Weight | 452.13 g/mol |
| LogP | 4.7523 |
| Topological Polar Surface Area | 93.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 452.13184 |
| Heavy Atoms | 32 |
| Complexity | 1144.9753 |
Chemical Identifiers
| CAS Number | 690248-70-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(CC(=O)NCC2=CC=CO2)SC3=NNC(=N3)C4=CC=C(C=C4)F |
Product Overview
AB01279525-01 (CAS 690248-70-5), with molecular formula C23H21FN4O3S and molecular weight 452.13 g/mol. IUPAC: 3-[[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)propanamide.
Chemical Property Profile of AB01279525-01
Property Insights of AB01279525-01
The XLogP value of 4.7523 indicates that AB01279525-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01279525-01. Following Lipinski's Rule of Five, AB01279525-01 has 2 hydrogen bond donor(s) and 6 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 AB01279525-01?
The CAS number of AB01279525-01 is 690248-70-5.
What is the molecular formula of AB01279525-01?
The molecular formula of AB01279525-01 is C23H21FN4O3S.
What is the molecular weight of AB01279525-01?
The molecular weight of AB01279525-01 is 452.13 g/mol.
Where can I buy AB01279525-01?
You can request a quote for AB01279525-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01279525-01?
Yes, KEHONG BIO provides custom synthesis services for AB01279525-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.