4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide
TL;DR: 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide (CAS 349614-32-0) is a chemical compound with molecular formula C12H12BrN3O2S and molecular weight 340.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
Also Known As: ChemDiv3_002531, 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide, 4-bromo-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide, BRD-K66084410-001-01-2, (4,6-dimethylpyrimidin-2-yl)[(4-bromophenyl)sulfonyl]amine
| Molecular Formula | C12H12BrN3O2S |
|---|---|
| Molecular Weight | 340.98 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.98337 |
| Heavy Atoms | 19 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 349614-32-0 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)Br)C |
| InChIKey | NZHHAKVDBRMLFL-UHFFFAOYSA-N |
Product Overview
4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide (CAS 349614-32-0), with molecular formula C12H12BrN3O2S and molecular weight 340.98 g/mol. IUPAC: 4-bromo-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide.
Chemical Property Profile of 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide
Property Insights of 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide 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 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide?
The CAS number of 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide is 349614-32-0.
What is the molecular formula of 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide?
The molecular formula of 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide is C12H12BrN3O2S.
What is the molecular weight of 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide?
The molecular weight of 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide is 340.98 g/mol.
Where can I buy 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide?
You can request a quote for 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.