4-bromo-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzene-1-sulfonamide
4-bromo-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8015-4892 |
| Compound Name: | 4-bromo-N-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}benzene-1-sulfonamide |
| Molecular Weight: | 468.25 |
| Molecular Formula: | C15 H13 Br F3 N3 O4 S |
| Smiles: | C(CNS(c1ccc(cc1)[Br])(=O)=O)Nc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.5087 |
| logD: | 4.5085 |
| logSw: | -4.5287 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.569 |
| InChI Key: | XCZJDSYBNVLCNJ-UHFFFAOYSA-N |