N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide
TL;DR: N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide (CAS 153312-38-0) is a chemical compound with molecular formula C12H12N4O4S and molecular weight 308.05792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4,6-dimethylpyrimidin-2-yl)-4-nitrobenzenesulfonamide
Also Known As: Cinuperone, N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide, 4-methoxy-1h-indol-3-methylamine, N-(4,6-dimethylpyrimidin-2-yl)-4-nitrobenzenesulfonamide, Benzenesulfonamide,N-(4,6-dimethyl-2-pyrimidinyl)-4-nitro-
Technical Specifications
| Molecular Formula | C12H12N4O4S |
| Molecular Weight | 308.05792 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.05792 Da |
| Heavy Atoms | 21 |
| Complexity | 455.0 |
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C |
| InChIKey | YIIHPIGMCBQDRD-UHFFFAOYSA-N |
Chemical Property Profile of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide
Property Insights of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide?
The CAS number of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide is 153312-38-0.
What is the molecular formula of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide?
The molecular formula of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide is C12H12N4O4S.
What is the molecular weight of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide?
The molecular weight of N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide is 308.05792 g/mol.
Where can I buy N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide?
You can request a quote for N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for N-(4,6-Dimethyl-2-pyrimidinyl)-4-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.