N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide
TL;DR: N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide (CAS 431933-86-7) is a chemical compound with molecular formula C16H16N4O2S and molecular weight 328.10 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-pyrrol-1-ylbenzenesulfonamide
Also Known As: TimTec1_007917, IDI1_033571, BAS 03450592, N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide, N-(4,6-dimethylpyrimidin-2-yl)-4-pyrrol-1-ylbenzenesulfonamide
| Molecular Formula | C16H16N4O2S |
|---|---|
| Molecular Weight | 328.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.0994 |
| Heavy Atoms | 23 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 431933-86-7 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N3C=CC=C3)C |
| InChIKey | MECPRKCBPHMOQU-UHFFFAOYSA-N |
Product Overview
N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide (CAS 431933-86-7), with molecular formula C16H16N4O2S and molecular weight 328.10 g/mol. IUPAC: N-(4,6-dimethylpyrimidin-2-yl)-4-pyrrol-1-ylbenzenesulfonamide.
Chemical Property Profile of N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide
Property Insights of N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide. Following Lipinski's Rule of Five, N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)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 N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide?
The CAS number of N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide is 431933-86-7.
What is the molecular formula of N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide?
The molecular formula of N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide is C16H16N4O2S.
What is the molecular weight of N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide?
The molecular weight of N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide is 328.10 g/mol.
Where can I buy N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide?
You can request a quote for N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide 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-(1H-pyrrol-1-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,6-dimethyl-2-pyrimidinyl)-4-(1H-pyrrol-1-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.