3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(prop-2-en-1-yl)oxy]phenyl}methyl)propan-1-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(prop-2-en-1-yl)oxy]phenyl}methyl)propan-1-amine--hydrogen chloride (1/1)
3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(prop-2-en-1-yl)oxy]phenyl}methyl)propan-1-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D272-0595 |
| Compound Name: | 3-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-({4-[(prop-2-en-1-yl)oxy]phenyl}methyl)propan-1-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 355.89 |
| Molecular Formula: | C15 H21 N5 O S |
| Salt: | HCl |
| Smiles: | [H]N(CCCSc1nnnn1C)Cc1ccc(cc1)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 1.5889 |
| logD: | -0.3466 |
| logSw: | -2.1767 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.607 |
| InChI Key: | ADJKKQYQVLEUMP-UHFFFAOYSA-N |