F2741-0096
TL;DR: F2741-0096 (CAS 1004172-36-4) is a chemical compound with molecular formula C23H21FN2O4 and molecular weight 408.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[2-[(4-fluorophenyl)methylamino]-2-oxoacetyl]-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
Also Known As: F2741-0096, ethyl 5-(2-((4-fluorobenzyl)amino)-2-oxoacetyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate, ethyl 5-({[(4-fluorophenyl)methyl]carbamoyl}carbonyl)-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate, ethyl 5-[2-[(4-fluorophenyl)methylamino]-2-oxoacetyl]-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
| Molecular Formula | C23H21FN2O4 |
|---|---|
| Molecular Weight | 408.15 g/mol |
| LogP | 3.80502 |
| Topological Polar Surface Area | 88.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.14853 |
| Heavy Atoms | 30 |
| Complexity | 1072.5875 |
Chemical Identifiers
| CAS Number | 1004172-36-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C1C2=CC=CC=C2)C(=O)C(=O)NCC3=CC=C(C=C3)F)C |
Product Overview
F2741-0096 (CAS 1004172-36-4), with molecular formula C23H21FN2O4 and molecular weight 408.15 g/mol. IUPAC: ethyl 5-[2-[(4-fluorophenyl)methylamino]-2-oxoacetyl]-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate.
Chemical Property Profile of F2741-0096
Property Insights of F2741-0096
The XLogP value of 3.80502 indicates that F2741-0096 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.26 Ų falls within the moderate polarity range, balancing permeability and solubility for F2741-0096. Following Lipinski's Rule of Five, F2741-0096 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F2741-0096?
The CAS number of F2741-0096 is 1004172-36-4.
What is the molecular formula of F2741-0096?
The molecular formula of F2741-0096 is C23H21FN2O4.
What is the molecular weight of F2741-0096?
The molecular weight of F2741-0096 is 408.15 g/mol.
Where can I buy F2741-0096?
You can request a quote for F2741-0096 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2741-0096?
Yes, KEHONG BIO provides custom synthesis services for F2741-0096 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.