4-methyl-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-methyl-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}benzene-1-sulfonamide
4-methyl-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8013-8668 |
| Compound Name: | 4-methyl-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}benzene-1-sulfonamide |
| Molecular Weight: | 417.4 |
| Molecular Formula: | C17 H18 F3 N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(NCCCNc1ccc(cc1[N+]([O-])=O)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3625 |
| logD: | 4.3624 |
| logSw: | -4.4055 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.569 |
| InChI Key: | WHHSOOYKGTYRJA-UHFFFAOYSA-N |