TL;DR: N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine (CAS 321434-02-0) is a chemical compound with molecular formula C14H10Cl2N2O4S and molecular weight 371.97385 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(benzenesulfonyl)-2-nitroethenyl]-3,4-dichloroaniline
Also Known As: Bionet1_001131, N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine, N-[2-(benzenesulfonyl)-2-nitroethenyl]-3,4-dichloroaniline
| Molecular Formula | C14H10Cl2N2O4S |
| Molecular Weight | 371.97385 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.97385 Da |
| Heavy Atoms | 23 |
| Complexity | 550.0 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC(=C(C=C2)Cl)Cl)[N+](=O)[O-] |
| InChIKey | BIBZUCGNDHWLIN-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine. Following Lipinski's Rule of Five, N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine is 321434-02-0.
The molecular formula of N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine is C14H10Cl2N2O4S.
The molecular weight of N-(3,4-dichlorophenyl)-N-[2-nitro-2-(phenylsulfonyl)vinyl]amine is 371.97385 g/mol.
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