N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
TL;DR: N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide (CAS 1007797-89-8) is a chemical compound with molecular formula C18H21NO4S and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
Also Known As: N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
| Molecular Formula | C18H21NO4S |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | 3.57396 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.11914 |
| Heavy Atoms | 24 |
| Complexity | 851.57776 |
Chemical Identifiers
| CAS Number | 1007797-89-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)C |
Product Overview
N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide (CAS 1007797-89-8), with molecular formula C18H21NO4S and molecular weight 347.12 g/mol. IUPAC: N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide.
Chemical Property Profile of N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
Property Insights of N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
The XLogP value of 3.57396 indicates that N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide. Following Lipinski's Rule of Five, N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide has 1 hydrogen bond donor(s) and 4 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-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
The CAS number of N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide is 1007797-89-8.
What is the molecular formula of N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
The molecular formula of N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide is C18H21NO4S.
What is the molecular weight of N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
The molecular weight of N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide is 347.12 g/mol.
Where can I buy N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
You can request a quote for N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4,6-trimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.