1-{[(2,4-dimethylphenyl)methyl][(oxolan-2-yl)methyl]amino}-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-{[(2,4-dimethylphenyl)methyl][(oxolan-2-yl)methyl]amino}-3-[(prop-2-en-1-yl)oxy]propan-2-ol
1-{[(2,4-dimethylphenyl)methyl][(oxolan-2-yl)methyl]amino}-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V028-0461 |
| Compound Name: | 1-{[(2,4-dimethylphenyl)methyl][(oxolan-2-yl)methyl]amino}-3-[(prop-2-en-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 333.47 |
| Molecular Formula: | C20 H31 N O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN(CC(COCC=C)O)CC2CCCO2)c(C)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0386 |
| logD: | 2.9992 |
| logSw: | -2.7745 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.577 |
| InChI Key: | VDVCGCJOKQKZFP-UHFFFAOYSA-N |