2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-fluorophenyl)methyl]amino}methyl)-N-[2-(dimethylamino)ethyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-fluorophenyl)methyl]amino}methyl)-N-[2-(dimethylamino)ethyl]-1,3-oxazole-4-carboxamide
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-fluorophenyl)methyl]amino}methyl)-N-[2-(dimethylamino)ethyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V012-6036 |
| Compound Name: | 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-fluorophenyl)methyl]amino}methyl)-N-[2-(dimethylamino)ethyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C24 H27 F N4 O4 |
| Salt: | not_available |
| Smiles: | CN(C)CCNC(c1coc(CN(Cc2ccc3c(c2)OCO3)Cc2ccccc2F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8044 |
| logD: | 1.6631 |
| logSw: | -3.2762 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.592 |
| InChI Key: | ZLCGQVGCZCISCB-UHFFFAOYSA-N |