1-{[(2,3-dimethoxyphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-{[(2,3-dimethoxyphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-{[(2,3-dimethoxyphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V028-5801 |
| Compound Name: | 1-{[(2,3-dimethoxyphenyl)methyl][(4-fluorophenyl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 387.45 |
| Molecular Formula: | C22 H26 F N O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(CN(CC(COCC#C)O)Cc2ccc(cc2)F)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1188 |
| logD: | 2.8723 |
| logSw: | -2.9917 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.27 |
| InChI Key: | AHHSVNASTUBNPJ-FQEVSTJZSA-N |