1-{(3-methoxypropyl)[(5-methylthiophen-2-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-{(3-methoxypropyl)[(5-methylthiophen-2-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-{(3-methoxypropyl)[(5-methylthiophen-2-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V006-0811 |
| Compound Name: | 1-{(3-methoxypropyl)[(5-methylthiophen-2-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 311.44 |
| Molecular Formula: | C16 H25 N O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN(CCCOC)CC(COCC#C)O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1786 |
| logD: | 1.6325 |
| logSw: | -2.2023 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.533 |
| InChI Key: | QTXLJFYLQIMLNH-HNNXBMFYSA-N |