N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide
TL;DR: N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide (CAS 349612-28-8) is a chemical compound with molecular formula C13H12FN3O and molecular weight 245.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide
Also Known As: BAS 03032735, N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide, N-(4,6-Dimethyl-pyrimidin-2-yl)-4-fluoro-benzamide, N-(4,6-dimethylpyrimidin-2-yl)(4-fluorophenyl)carboxamide, Cambridge id 6592300
| Molecular Formula | C13H12FN3O |
|---|---|
| Molecular Weight | 245.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 54.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.09644 |
| Heavy Atoms | 18 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 349612-28-8 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(=O)C2=CC=C(C=C2)F)C |
| InChIKey | XYIUTPJXOLQYJB-UHFFFAOYSA-N |
Product Overview
N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide (CAS 349612-28-8), with molecular formula C13H12FN3O and molecular weight 245.10 g/mol. IUPAC: N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide.
Chemical Property Profile of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide
Property Insights of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide. With a topological polar surface area (TPSA) of 54.9 Ų, N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide 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 N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide?
The CAS number of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide is 349612-28-8.
What is the molecular formula of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide?
The molecular formula of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide is C13H12FN3O.
What is the molecular weight of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide?
The molecular weight of N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide is 245.10 g/mol.
Where can I buy N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide?
You can request a quote for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,6-dimethylpyrimidin-2-yl)-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.