4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide
TL;DR: 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide (CAS 99170-74-8) is a chemical compound with molecular formula C10H14N2O4S and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide
Also Known As: BAS 00356489, 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide, AB00076485-01, N-Isopropyl-4-methyl-3-nitro-benzenesulfonamide, 4-methyl-3-nitro-N-(propan-2-yl)benzenesulfonamide
| Molecular Formula | C10H14N2O4S |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | 1.58992 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.0674 |
| Heavy Atoms | 17 |
| Complexity | 537.23694 |
Chemical Identifiers
| CAS Number | 99170-74-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)NC(C)C)[N+](=O)[O-] |
Product Overview
4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide (CAS 99170-74-8), with molecular formula C10H14N2O4S and molecular weight 258.07 g/mol. IUPAC: 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide.
Chemical Property Profile of 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide
Property Insights of 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide
The XLogP value of 1.58992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide. Following Lipinski's Rule of Five, 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide 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 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide?
The CAS number of 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide is 99170-74-8.
What is the molecular formula of 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide?
The molecular formula of 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide is C10H14N2O4S.
What is the molecular weight of 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide?
The molecular weight of 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide is 258.07 g/mol.
Where can I buy 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide?
You can request a quote for 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-nitro-N-propan-2-ylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.