N-benzyl-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine
Chemical Structure Depiction of
N-benzyl-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine
N-benzyl-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine
Compound characteristics
| Compound ID: | D272-0294 |
| Compound Name: | N-benzyl-3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propan-1-amine |
| Molecular Weight: | 361.89 |
| Molecular Formula: | C17 H19 N5 S |
| Salt: | HCl |
| Smiles: | [H]N(CCCSc1nnnn1c1ccccc1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6754 |
| logD: | 0.4812 |
| logSw: | -2.7574 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.768 |
| InChI Key: | ICIBPCLZDWQECO-UHFFFAOYSA-N |