5-{[(4-nitrophenyl)methyl]sulfanyl}-1-phenyl-1H-tetrazole
Chemical Structure Depiction of
5-{[(4-nitrophenyl)methyl]sulfanyl}-1-phenyl-1H-tetrazole
5-{[(4-nitrophenyl)methyl]sulfanyl}-1-phenyl-1H-tetrazole
Compound characteristics
| Compound ID: | 8012-8837 |
| Compound Name: | 5-{[(4-nitrophenyl)methyl]sulfanyl}-1-phenyl-1H-tetrazole |
| Molecular Weight: | 313.34 |
| Molecular Formula: | C14 H11 N5 O2 S |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Sc1nnnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0238 |
| logD: | 3.0238 |
| logSw: | -3.3508 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.27 |
| InChI Key: | XINSQOLXINNYJA-UHFFFAOYSA-N |