1-{[(2,5-dimethylphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-{[(2,5-dimethylphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-{[(2,5-dimethylphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V010-9887 |
| Compound Name: | 1-{[(2,5-dimethylphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 355.45 |
| Molecular Formula: | C22 H26 F N O2 |
| Smiles: | Cc1ccc(C)c(CN(CC(COCC#C)O)Cc2ccc(cc2)F)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2932 |
| logD: | 4.2795 |
| logSw: | -4.2242 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.9225 |
| InChI Key: | MITHRBTZINDNQO-QFIPXVFZSA-N |