Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-
TL;DR: Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- (CAS 19117-41-0) is a chemical compound with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-(4-nitrophenyl)sulfanylpropan-2-amine
Also Known As: 4-nitro-N-tert-butyl-benzenesulfenamide, Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-, J2.247.952K, S-(4-Nitrophenyl)-N-tert-butylthiohydroxylamine, TERT-BUTYL[(4-NITROPHENYL)SULFANYL]AMINE
| Molecular Formula | C10H14N2O2S |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 2.99 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.0776 |
| Heavy Atoms | 15 |
| Complexity | 343.43518 |
Chemical Identifiers
| CAS Number | 19117-41-0 |
|---|---|
| SMILES | CC(C)(C)NSC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- (CAS 19117-41-0), with molecular formula C10H14N2O2S and molecular weight 226.08 g/mol. IUPAC: 2-methyl-N-(4-nitrophenyl)sulfanylpropan-2-amine.
Chemical Property Profile of Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-
Property Insights of Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-
The XLogP value of 2.99 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-. With a topological polar surface area (TPSA) of 55.17 Ų, Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- 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 Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-?
The CAS number of Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- is 19117-41-0.
What is the molecular formula of Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-?
The molecular formula of Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- is C10H14N2O2S.
What is the molecular weight of Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-?
The molecular weight of Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- is 226.08 g/mol.
Where can I buy Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-?
You can request a quote for Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfenamide, N-(1,1-dimethylethyl)-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.