4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide
TL;DR: 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide (CAS 349613-97-4) is a chemical compound with molecular formula C13H12ClN3O and molecular weight 261.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide
Also Known As: 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide, 4-chloro-N-(4,6-dimethyl-2-pyrimidinyl)benzamide, AA-504/07986005, N-(4,6-dimethylpyrimidin-2-yl)(4-chlorophenyl)carboxamide
| Molecular Formula | C13H12ClN3O |
|---|---|
| Molecular Weight | 261.07 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 54.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.0669 |
| Heavy Atoms | 18 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 349613-97-4 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(=O)C2=CC=C(C=C2)Cl)C |
| InChIKey | ASTPLJPNQUONOY-UHFFFAOYSA-N |
Product Overview
4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide (CAS 349613-97-4), with molecular formula C13H12ClN3O and molecular weight 261.07 g/mol. IUPAC: 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide.
Chemical Property Profile of 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide
Property Insights of 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide. With a topological polar surface area (TPSA) of 54.9 Ų, 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide has 1 hydrogen bond donor(s) and 3 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 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide?
The CAS number of 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide is 349613-97-4.
What is the molecular formula of 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide?
The molecular formula of 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide is C13H12ClN3O.
What is the molecular weight of 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide?
The molecular weight of 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide is 261.07 g/mol.
Where can I buy 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide?
You can request a quote for 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.