F0514-0154
TL;DR: F0514-0154 (CAS 362502-33-8) is a chemical compound with molecular formula C37H36N6O5S and molecular weight 676.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-[3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide
Also Known As: F0514-0154, N-{[5-({2-[5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}-3-methylbenzamide, N-((5-((2-(5-(2,3-dimethoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)-2-oxoethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)-3-methylbenzamide, N-[[5-[2-[3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide, N-[(5-{2-[5-(2,3-dimethoxyphenyl)-3-(p-methoxyphenyl)-2-pyrazolin-1-yl]-2-oxoethylthio}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-m-toluamide
| Molecular Formula | C37H36N6O5S |
|---|---|
| Molecular Weight | 676.25 g/mol |
| LogP | 6.00152 |
| Topological Polar Surface Area | 120.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 676.24677 |
| Heavy Atoms | 49 |
| Complexity | 1979.3728 |
Chemical Identifiers
| CAS Number | 362502-33-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4C(CC(=N4)C5=CC=C(C=C5)OC)C6=C(C(=CC=C6)OC)OC |
Product Overview
F0514-0154 (CAS 362502-33-8), with molecular formula C37H36N6O5S and molecular weight 676.25 g/mol. IUPAC: N-[[5-[2-[3-(2,3-dimethoxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide.
Chemical Property Profile of F0514-0154
Property Insights of F0514-0154
The XLogP value of 6.00152 indicates that F0514-0154 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.17 Ų falls within the moderate polarity range, balancing permeability and solubility for F0514-0154. Following Lipinski's Rule of Five, F0514-0154 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 F0514-0154?
The CAS number of F0514-0154 is 362502-33-8.
What is the molecular formula of F0514-0154?
The molecular formula of F0514-0154 is C37H36N6O5S.
What is the molecular weight of F0514-0154?
The molecular weight of F0514-0154 is 676.25 g/mol.
Where can I buy F0514-0154?
You can request a quote for F0514-0154 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0514-0154?
Yes, KEHONG BIO provides custom synthesis services for F0514-0154 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.