F0514-4562
TL;DR: F0514-4562 (CAS 393586-27-1) is a chemical compound with molecular formula C35H34N6O4S and molecular weight 634.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(2,5-dimethylphenyl)-5-[2-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
Also Known As: F0514-4562, N-((4-(2,5-dimethylphenyl)-5-((2-(3-(4-methoxyphenyl)-5-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)furan-2-carboxamide, N-{[4-(2,5-dimethylphenyl)-5-({2-[3-(4-methoxyphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}furan-2-carboxamide, N-[[4-(2,5-dimethylphenyl)-5-[2-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
| Molecular Formula | C35H34N6O4S |
|---|---|
| Molecular Weight | 634.24 g/mol |
| LogP | 6.19416 |
| Topological Polar Surface Area | 114.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 634.2362 |
| Heavy Atoms | 46 |
| Complexity | 1881.4047 |
Chemical Identifiers
| CAS Number | 393586-27-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=NN=C(N3C4=C(C=CC(=C4)C)C)CNC(=O)C5=CC=CO5)C6=CC=C(C=C6)OC |
Product Overview
F0514-4562 (CAS 393586-27-1), with molecular formula C35H34N6O4S and molecular weight 634.24 g/mol. IUPAC: N-[[4-(2,5-dimethylphenyl)-5-[2-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide.
Chemical Property Profile of F0514-4562
Property Insights of F0514-4562
The XLogP value of 6.19416 indicates that F0514-4562 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.85 Ų falls within the moderate polarity range, balancing permeability and solubility for F0514-4562. Following Lipinski's Rule of Five, F0514-4562 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0514-4562?
The CAS number of F0514-4562 is 393586-27-1.
What is the molecular formula of F0514-4562?
The molecular formula of F0514-4562 is C35H34N6O4S.
What is the molecular weight of F0514-4562?
The molecular weight of F0514-4562 is 634.24 g/mol.
Where can I buy F0514-4562?
You can request a quote for F0514-4562 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0514-4562?
Yes, KEHONG BIO provides custom synthesis services for F0514-4562 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.