5-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1-phenyl-1H-tetrazole
Chemical Structure Depiction of
5-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1-phenyl-1H-tetrazole
5-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1-phenyl-1H-tetrazole
Compound characteristics
| Compound ID: | 8004-3264 |
| Compound Name: | 5-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1-phenyl-1H-tetrazole |
| Molecular Weight: | 367.31 |
| Molecular Formula: | C14 H8 F3 N5 O2 S |
| Smiles: | c1ccc(cc1)n1c(nnn1)Sc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.4745 |
| logD: | 4.4745 |
| logSw: | -4.6693 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.969 |
| InChI Key: | UQKWWEBDEOPKDB-UHFFFAOYSA-N |