F2697-0031
TL;DR: F2697-0031 (CAS 1002218-01-0) is a chemical compound with molecular formula C20H21N5O4 and molecular weight 395.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide
Also Known As: F2697-0031, N-(2H-1,3-benzodioxol-5-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-1-yl]acetamide, N-(1,3-benzodioxol-5-yl)-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide, N-(benzo[d][1,3]dioxol-5-yl)-2-(2-(3,5-dimethyl-1H-pyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1(6H)-yl)acetamide
| Molecular Formula | C20H21N5O4 |
|---|---|
| Molecular Weight | 395.16 g/mol |
| LogP | 2.03008 |
| Topological Polar Surface Area | 100.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.15936 |
| Heavy Atoms | 29 |
| Complexity | 1178.3452 |
Chemical Identifiers
| CAS Number | 1002218-01-0 |
|---|---|
| SMILES | CC1=CC(=NN1C2=NC(=C(C(=O)N2CC(=O)NC3=CC4=C(C=C3)OCO4)C)C)C |
Product Overview
F2697-0031 (CAS 1002218-01-0), with molecular formula C20H21N5O4 and molecular weight 395.16 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[2-(3,5-dimethylpyrazol-1-yl)-4,5-dimethyl-6-oxopyrimidin-1-yl]acetamide.
Chemical Property Profile of F2697-0031
Property Insights of F2697-0031
The XLogP value of 2.03008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2697-0031. The TPSA of 100.27 Ų falls within the moderate polarity range, balancing permeability and solubility for F2697-0031. Following Lipinski's Rule of Five, F2697-0031 has 1 hydrogen bond donor(s) and 6 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 F2697-0031?
The CAS number of F2697-0031 is 1002218-01-0.
What is the molecular formula of F2697-0031?
The molecular formula of F2697-0031 is C20H21N5O4.
What is the molecular weight of F2697-0031?
The molecular weight of F2697-0031 is 395.16 g/mol.
Where can I buy F2697-0031?
You can request a quote for F2697-0031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2697-0031?
Yes, KEHONG BIO provides custom synthesis services for F2697-0031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.