F2697-0096
TL;DR: F2697-0096 (CAS 1002835-76-8) is a chemical compound with molecular formula C20H22ClN5O2 and molecular weight 399.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide
Also Known As: F2697-0096, N-[(2-chlorophenyl)methyl]-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-1-yl]acetamide, N-[(2-chlorophenyl)methyl]-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide, N-(2-chlorobenzyl)-2-(2-(3,5-dimethyl-1H-pyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1(6H)-yl)acetamide
| Molecular Formula | C20H22ClN5O2 |
|---|---|
| Molecular Weight | 399.15 g/mol |
| LogP | 2.63248 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1462 |
| Heavy Atoms | 28 |
| Complexity | 1100.4609 |
Chemical Identifiers
| CAS Number | 1002835-76-8 |
|---|---|
| SMILES | CC1=CC(=NN1C2=NC(=C(C(=O)N2CC(=O)NCC3=CC=CC=C3Cl)C)C)C |
Product Overview
F2697-0096 (CAS 1002835-76-8), with molecular formula C20H22ClN5O2 and molecular weight 399.15 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide.
Chemical Property Profile of F2697-0096
Property Insights of F2697-0096
The XLogP value of 2.63248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2697-0096. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for F2697-0096. Following Lipinski's Rule of Five, F2697-0096 has 1 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 F2697-0096?
The CAS number of F2697-0096 is 1002835-76-8.
What is the molecular formula of F2697-0096?
The molecular formula of F2697-0096 is C20H22ClN5O2.
What is the molecular weight of F2697-0096?
The molecular weight of F2697-0096 is 399.15 g/mol.
Where can I buy F2697-0096?
You can request a quote for F2697-0096 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2697-0096?
Yes, KEHONG BIO provides custom synthesis services for F2697-0096 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.