N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide (CAS 333444-46-5) is a chemical compound with molecular formula C16H17NO5S and molecular weight 335.08 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-methoxy-3-methylbenzenesulfonamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide, UPCMLD0ENAT5950877:001, BAS 07595041, N-Benzo[1,3]dioxol-5-ylmethyl-4-methoxy-3-methyl-benzenesulfonamide, (2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)[(4-methoxy-3-methylphenyl)sulfonyl]am ine
| Molecular Formula | C16H17NO5S |
|---|---|
| Molecular Weight | 335.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 82.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.08273 |
| Heavy Atoms | 23 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 333444-46-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)OC |
| InChIKey | IXAROBUHQZAJIF-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide (CAS 333444-46-5), with molecular formula C16H17NO5S and molecular weight 335.08 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide. The TPSA of 82.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide has 1 hydrogen bond donor(s) and 6 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-methoxy-3-methylbenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide is 333444-46-5.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide is C16H17NO5S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide is 335.08 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-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-methoxy-3-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.