5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1-(naphthalen-1-yl)-1H-tetrazole
Chemical Structure Depiction of
5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1-(naphthalen-1-yl)-1H-tetrazole
5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1-(naphthalen-1-yl)-1H-tetrazole
Compound characteristics
| Compound ID: | 8005-1916 |
| Compound Name: | 5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1-(naphthalen-1-yl)-1H-tetrazole |
| Molecular Weight: | 393.42 |
| Molecular Formula: | C19 H15 N5 O3 S |
| Smiles: | COc1ccc(CSc2nnnn2c2cccc3ccccc23)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.155 |
| logD: | 4.155 |
| logSw: | -4.4479 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.027 |
| InChI Key: | USGNYRHBEHSNJD-UHFFFAOYSA-N |