N-{[2-(benzyloxy)phenyl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
Chemical Structure Depiction of
N-{[2-(benzyloxy)phenyl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
N-{[2-(benzyloxy)phenyl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
Compound characteristics
| Compound ID: | D660-0011 |
| Compound Name: | N-{[2-(benzyloxy)phenyl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine |
| Molecular Weight: | 391.92 |
| Molecular Formula: | C18 H21 N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1C)Cc1ccccc1OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6332 |
| logD: | -0.2961 |
| logSw: | -2.9464 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.503 |
| InChI Key: | XQODSJBZAFNXFQ-UHFFFAOYSA-N |