N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide
TL;DR: N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide (CAS 347355-71-9) is a chemical compound with molecular formula C12H18ClN3O4S and molecular weight 335.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2-chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide
Also Known As: N-{3-[(2-chloro-4-nitrophenyl)amino]-2,2-dimethylpropyl}methanesulfonamide, A2481/0105412, N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide, N-(3-{2-chloro-4-nitroanilino}-2,2-dimethylpropyl)methanesulfonamide, N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide #
| Molecular Formula | C12H18ClN3O4S |
|---|---|
| Molecular Weight | 335.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.07065 |
| Heavy Atoms | 21 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 347355-71-9 |
|---|---|
| SMILES | CC(C)(CNC1=C(C=C(C=C1)[N+](=O)[O-])Cl)CNS(=O)(=O)C |
| InChIKey | NGAQVSJGAFWSDS-UHFFFAOYSA-N |
Product Overview
N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide (CAS 347355-71-9), with molecular formula C12H18ClN3O4S and molecular weight 335.07 g/mol. IUPAC: N-[3-(2-chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide.
Chemical Property Profile of N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide
Property Insights of N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide
The XLogP value of 3.2 indicates that N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide. Following Lipinski's Rule of Five, N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide has 2 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-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide?
The CAS number of N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide is 347355-71-9.
What is the molecular formula of N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide?
The molecular formula of N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide is C12H18ClN3O4S.
What is the molecular weight of N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide?
The molecular weight of N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide is 335.07 g/mol.
Where can I buy N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide?
You can request a quote for N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(2-Chloro-4-nitroanilino)-2,2-dimethylpropyl]methanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.