N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide (CAS 128924-76-5) is a chemical compound with molecular formula C15H14N2O5S and molecular weight 334.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)sulfonylurea
Also Known As: N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide, 3-(2H-1,3-benzodioxol-5-yl)-1-(4-methylbenzenesulfonyl)urea, 1-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)sulfonylurea, 1-(1,3-Benzodioxol-5-yl)-3-(4-methylphenylsulfonyl)urea, 3-benzo[1,3]dioxol-5-yl-1-(4-methylphenyl)sulfonyl-urea
| Molecular Formula | C15H14N2O5S |
|---|---|
| Molecular Weight | 334.06 g/mol |
| LogP | 2.23412 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.06235 |
| Heavy Atoms | 23 |
| Complexity | 846.671 |
Chemical Identifiers
| CAS Number | 128924-76-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide (CAS 128924-76-5), with molecular formula C15H14N2O5S and molecular weight 334.06 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)sulfonylurea.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide
The XLogP value of 2.23412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide has 2 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-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide is 128924-76-5.
What is the molecular formula of N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide is C15H14N2O5S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide is 334.06 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylcarbamoyl)-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-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylcarbamoyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.