N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide
TL;DR: N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide (CAS 123458-65-1) is a chemical compound with molecular formula C13H15N3O2S and molecular weight 277.09 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-methylbenzenesulfonamide
Also Known As: 2-tosylamino-4,6-dimethylpyrimidine, N-(4,6-dimethylpyrimidin-2-yl)-4-methylbenzenesulfonamide, AB00015821-01, (4,6-dimethylpyrimidin-2-yl)[(4-methylphenyl)sulfonyl]amine, N-(4,6-DIMETHYL-2-PYRIMIDINYL)-4-METHYLBENZENESULFONAMIDE
| Molecular Formula | C13H15N3O2S |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.0885 |
| Heavy Atoms | 19 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 123458-65-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)C)C |
| InChIKey | PJKGKLPRSSNDFO-UHFFFAOYSA-N |
Product Overview
N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide (CAS 123458-65-1), with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol. IUPAC: N-(4,6-dimethylpyrimidin-2-yl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide
Property Insights of N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide has 1 hydrogen bond donor(s) and 5 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-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide?
The CAS number of N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide is 123458-65-1.
What is the molecular formula of N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide is C13H15N3O2S.
What is the molecular weight of N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide is 277.09 g/mol.
Where can I buy N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide 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-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,6-Dimethyl-2-pyrimidinyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.