N-[(4-chlorophenyl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
N-[(4-chlorophenyl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine
Compound characteristics
| Compound ID: | D660-0003 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-amine |
| Molecular Weight: | 320.24 |
| Molecular Formula: | C11 H14 Cl N5 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1C)Cc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.4579 |
| logD: | -1.1001 |
| logSw: | -2.2304 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.189 |
| InChI Key: | BRUKTCLRAQJSAW-UHFFFAOYSA-N |