N-{[2-(benzyloxy)naphthalen-1-yl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-{[2-(benzyloxy)naphthalen-1-yl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
N-{[2-(benzyloxy)naphthalen-1-yl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D660-0031 |
| Compound Name: | N-{[2-(benzyloxy)naphthalen-1-yl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 441.98 |
| Molecular Formula: | C22 H23 N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1C)Cc1c(ccc2ccccc12)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5724 |
| logD: | 1.4156 |
| logSw: | -3.9772 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.232 |
| InChI Key: | DJHYDSZCFLEUJY-UHFFFAOYSA-N |