4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide
TL;DR: 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide (CAS 379726-97-3) is a chemical compound with molecular formula C14H20N2O5S and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(7-nitro-6-oxoheptyl)benzenesulfonamide
Also Known As: 1-Nitro-7-(tosylamino)-2-heptanone, J1.986.241K, 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide, 4-methyl-N-(7-nitro-6-oxoheptyl)benzenesulfonamide
| Molecular Formula | C14H20N2O5S |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 1.67952 |
| Topological Polar Surface Area | 106.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 328.10928 |
| Heavy Atoms | 22 |
| Complexity | 610.6253 |
Chemical Identifiers
| CAS Number | 379726-97-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)C[N+](=O)[O-] |
Product Overview
4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide (CAS 379726-97-3), with molecular formula C14H20N2O5S and molecular weight 328.11 g/mol. IUPAC: 4-methyl-N-(7-nitro-6-oxoheptyl)benzenesulfonamide.
Chemical Property Profile of 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide
Property Insights of 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide
The XLogP value of 1.67952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide. The TPSA of 106.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide. Following Lipinski's Rule of Five, 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide 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 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide?
The CAS number of 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide is 379726-97-3.
What is the molecular formula of 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide?
The molecular formula of 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide is C14H20N2O5S.
What is the molecular weight of 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide?
The molecular weight of 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide is 328.11 g/mol.
Where can I buy 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide?
You can request a quote for 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-(7-nitro-6-oxoheptyl)benzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.