F0514-3999
TL;DR: F0514-3999 (CAS 393584-97-9) is a chemical compound with molecular formula C34H32N6O2S2 and molecular weight 620.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(3-methylphenyl)-5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide
Also Known As: F0514-3999, N-{[4-(3-methylphenyl)-5-({2-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-2-phenylacetamide, N-((5-((2-oxo-2-(3-(thiophen-2-yl)-5-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)ethyl)thio)-4-(m-tolyl)-4H-1,2,4-triazol-3-yl)methyl)-2-phenylacetamide, N-[[4-(3-methylphenyl)-5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide
| Molecular Formula | C34H32N6O2S2 |
|---|---|
| Molecular Weight | 620.20 g/mol |
| LogP | 6.27454 |
| Topological Polar Surface Area | 92.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 620.2028 |
| Heavy Atoms | 44 |
| Complexity | 1782.2999 |
Chemical Identifiers
| CAS Number | 393584-97-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=NN=C(N3C4=CC=CC(=C4)C)CNC(=O)CC5=CC=CC=C5)C6=CC=CS6 |
Product Overview
F0514-3999 (CAS 393584-97-9), with molecular formula C34H32N6O2S2 and molecular weight 620.20 g/mol. IUPAC: N-[[4-(3-methylphenyl)-5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide.
Chemical Property Profile of F0514-3999
Property Insights of F0514-3999
The XLogP value of 6.27454 indicates that F0514-3999 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.48 Ų falls within the moderate polarity range, balancing permeability and solubility for F0514-3999. Following Lipinski's Rule of Five, F0514-3999 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0514-3999?
The CAS number of F0514-3999 is 393584-97-9.
What is the molecular formula of F0514-3999?
The molecular formula of F0514-3999 is C34H32N6O2S2.
What is the molecular weight of F0514-3999?
The molecular weight of F0514-3999 is 620.20 g/mol.
Where can I buy F0514-3999?
You can request a quote for F0514-3999 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0514-3999?
Yes, KEHONG BIO provides custom synthesis services for F0514-3999 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.