N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
TL;DR: N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide (CAS 879182-39-5) is a chemical compound with molecular formula C15H21NO4S and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
Also Known As: N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide, F2242-0102, N-cyclohexyl-3,4-dihydro-2H-benzo[b][1,4]dioxepine-7-sulfonamide, (cyclohexylamino)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)-lambda-sulfaniumolate
| Molecular Formula | C15H21NO4S |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 2.4589 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.11914 |
| Heavy Atoms | 21 |
| Complexity | 593.6912 |
Chemical Identifiers
| CAS Number | 879182-39-5 |
|---|---|
| SMILES | C1CCC(CC1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3 |
Product Overview
N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide (CAS 879182-39-5), with molecular formula C15H21NO4S and molecular weight 311.12 g/mol. IUPAC: N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide.
Chemical Property Profile of N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
Property Insights of N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
The XLogP value of 2.4589 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide. Following Lipinski's Rule of Five, N-cyclohexyl-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-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
The CAS number of N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide is 879182-39-5.
What is the molecular formula of N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
The molecular formula of N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide is C15H21NO4S.
What is the molecular weight of N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
The molecular weight of N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide is 311.12 g/mol.
Where can I buy N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
You can request a quote for N-cyclohexyl-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-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclohexyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.