F0514-4587
TL;DR: F0514-4587 (CAS 393586-40-8) is a chemical compound with molecular formula C32H30N6O4S2 and molecular weight 626.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-ethoxyphenyl)-5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
Also Known As: F0514-4587, N-((4-(4-ethoxyphenyl)-5-((2-oxo-2-(3-(thiophen-2-yl)-5-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)ethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)furan-2-carboxamide, N-{[4-(4-ethoxyphenyl)-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}furan-2-carboxamide, N-[[4-(4-ethoxyphenyl)-5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
| Molecular Formula | C32H30N6O4S2 |
|---|---|
| Molecular Weight | 626.18 g/mol |
| LogP | 6.02892 |
| Topological Polar Surface Area | 114.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 626.177 |
| Heavy Atoms | 44 |
| Complexity | 1747.3035 |
Chemical Identifiers
| CAS Number | 393586-40-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N3C(CC(=N3)C4=CC=CS4)C5=CC=C(C=C5)C)CNC(=O)C6=CC=CO6 |
Product Overview
F0514-4587 (CAS 393586-40-8), with molecular formula C32H30N6O4S2 and molecular weight 626.18 g/mol. IUPAC: N-[[4-(4-ethoxyphenyl)-5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide.
Chemical Property Profile of F0514-4587
Property Insights of F0514-4587
The XLogP value of 6.02892 indicates that F0514-4587 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 F0514-4587. Following Lipinski's Rule of Five, F0514-4587 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0514-4587?
The CAS number of F0514-4587 is 393586-40-8.
What is the molecular formula of F0514-4587?
The molecular formula of F0514-4587 is C32H30N6O4S2.
What is the molecular weight of F0514-4587?
The molecular weight of F0514-4587 is 626.18 g/mol.
Where can I buy F0514-4587?
You can request a quote for F0514-4587 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0514-4587?
Yes, KEHONG BIO provides custom synthesis services for F0514-4587 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.