N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide (CAS 22102-40-5) is a chemical compound with molecular formula C15H15NO4S and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide
Also Known As: N-(Piperonyl)-4-methylbenzenesulfonamide, BIM-0016965.P001, N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide, J2.161.796B, A2660/0113434
| Molecular Formula | C15H15NO4S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 73.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.07217 |
| Heavy Atoms | 21 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 22102-40-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3 |
| InChIKey | DJLQOIQOXRJOLS-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide (CAS 22102-40-5), with molecular formula C15H15NO4S and molecular weight 305.07 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide. The TPSA of 73.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-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-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide is 22102-40-5.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide is C15H15NO4S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide is 305.07 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-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-ylmethyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.