1-([(2H-1,3-benzodioxol-5-yl)methyl]{[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-([(2H-1,3-benzodioxol-5-yl)methyl]{[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-([(2H-1,3-benzodioxol-5-yl)methyl]{[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V023-0722 |
| Compound Name: | 1-([(2H-1,3-benzodioxol-5-yl)methyl]{[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 509.58 |
| Molecular Formula: | C28 H32 F N3 O5 |
| Smiles: | CCN(CC)c1c(CN(CC(COCC#C)O)Cc2ccc3c(c2)OCO3)c(c2ccc(cc2)F)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1569 |
| logD: | 1.6696 |
| logSw: | -4.3264 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.62 |
| InChI Key: | RUFPLVKRKNPWLD-QHCPKHFHSA-N |