3-[4-nitro-2-(trifluoromethyl)anilino]propyl (3-chlorophenyl)carbamate
Chemical Structure Depiction of
3-[4-nitro-2-(trifluoromethyl)anilino]propyl (3-chlorophenyl)carbamate
3-[4-nitro-2-(trifluoromethyl)anilino]propyl (3-chlorophenyl)carbamate
Compound characteristics
| Compound ID: | 8015-0959 |
| Compound Name: | 3-[4-nitro-2-(trifluoromethyl)anilino]propyl (3-chlorophenyl)carbamate |
| Molecular Weight: | 417.77 |
| Molecular Formula: | C17 H15 Cl F3 N3 O4 |
| Smiles: | C(CNc1ccc(cc1C(F)(F)F)[N+]([O-])=O)COC(Nc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.72 |
| logD: | 5.7189 |
| logSw: | -5.9379 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.736 |
| InChI Key: | BSPYAFJTRQVXOX-UHFFFAOYSA-N |