N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline
TL;DR: N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline (CAS 6304-97-8) is a chemical compound with molecular formula C15H14N4O4S and molecular weight 346.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-benzylsulfanylethylideneamino)-2,4-dinitroaniline
Also Known As: N-(2-benzylsulfanylethylideneamino)-2,4-dinitroaniline, N-(2-BENZYLSULFANYLETHYLIDENEAMINO)-2,4-DINITRO-ANILINE, Benzyl-mercapto-acetaldehyd-<2.4-dinitro-phenylhydrazon>, 1-[2-(Benzylsulfanyl)ethylidene]-2-(2,4-dinitrophenyl)hydrazine
| Molecular Formula | C15H14N4O4S |
|---|---|
| Molecular Weight | 346.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 346.07358 |
| Heavy Atoms | 24 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 6304-97-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCC=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | RGSKENGFZSJEIX-UHFFFAOYSA-N |
Product Overview
N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline (CAS 6304-97-8), with molecular formula C15H14N4O4S and molecular weight 346.07 g/mol. IUPAC: N-(2-benzylsulfanylethylideneamino)-2,4-dinitroaniline.
Chemical Property Profile of N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline
Property Insights of N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline
The XLogP value of 3.0 indicates that N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline has 1 hydrogen bond donor(s) and 7 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-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline?
The CAS number of N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline is 6304-97-8.
What is the molecular formula of N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline?
The molecular formula of N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline is C15H14N4O4S.
What is the molecular weight of N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline?
The molecular weight of N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline is 346.07 g/mol.
Where can I buy N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline?
You can request a quote for N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Benzylsulfanylethylideneamino)-2,4-dinitro-aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.