3-phenyl-N-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}prop-2-en-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-phenyl-N-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}prop-2-en-1-amine--hydrogen chloride (1/1)
3-phenyl-N-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}prop-2-en-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0332 |
| Compound Name: | 3-phenyl-N-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}prop-2-en-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 387.93 |
| Molecular Formula: | C19 H21 N5 S |
| Salt: | HCl |
| Smiles: | [H]N(CCCSc1nnnn1c1ccccc1)C/C=C/c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4864 |
| logD: | 2.2255 |
| logSw: | -3.6373 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.609 |
| InChI Key: | HXZWKNTWCQABGY-YRNVUSSQSA-N |