3-phenyl-N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}prop-2-yn-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-phenyl-N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}prop-2-yn-1-amine--hydrogen chloride (1/1)
3-phenyl-N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}prop-2-yn-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0207 |
| Compound Name: | 3-phenyl-N-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}prop-2-yn-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 371.89 |
| Molecular Formula: | C18 H17 N5 S |
| Salt: | HCl |
| Smiles: | [H]N(CCSc1nnnn1c1ccccc1)CC#Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1936 |
| logD: | 2.9685 |
| logSw: | -3.1682 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.609 |
| InChI Key: | LZUWCUCQOBEANV-UHFFFAOYSA-N |