F0514-0075
TL;DR: F0514-0075 (CAS 393573-30-3) is a chemical compound with molecular formula C32H27N7O4S2 and molecular weight 637.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: F0514-0075, N-((4-(4-nitrophenyl)-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)benzamide, N-[[5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]benzamide, N-{[5-({2-[5-(4-METHYLPHENYL)-3-(THIOPHEN-2-YL)-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-2-OXOETHYL}SULFANYL)-4-(4-NITROPHENYL)-4H-1,2,4-TRIAZOL-3-YL]METHYL}BENZAMIDE
| Molecular Formula | C32H27N7O4S2 |
|---|---|
| Molecular Weight | 637.16 g/mol |
| LogP | 5.94542 |
| Topological Polar Surface Area | 135.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 637.1566 |
| Heavy Atoms | 45 |
| Complexity | 1855.9946 |
Chemical Identifiers
| CAS Number | 393573-30-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=NN=C(N3C4=CC=C(C=C4)[N+](=O)[O-])CNC(=O)C5=CC=CC=C5)C6=CC=CS6 |
Product Overview
F0514-0075 (CAS 393573-30-3), with molecular formula C32H27N7O4S2 and molecular weight 637.16 g/mol. IUPAC: N-[[5-[2-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]sulfanyl-4-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]benzamide.
Chemical Property Profile of F0514-0075
Property Insights of F0514-0075
The XLogP value of 5.94542 indicates that F0514-0075 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.62 Ų falls within the moderate polarity range, balancing permeability and solubility for F0514-0075. Following Lipinski's Rule of Five, F0514-0075 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 F0514-0075?
The CAS number of F0514-0075 is 393573-30-3.
What is the molecular formula of F0514-0075?
The molecular formula of F0514-0075 is C32H27N7O4S2.
What is the molecular weight of F0514-0075?
The molecular weight of F0514-0075 is 637.16 g/mol.
Where can I buy F0514-0075?
You can request a quote for F0514-0075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0514-0075?
Yes, KEHONG BIO provides custom synthesis services for F0514-0075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.