2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V023-9913 |
| Compound Name: | 2-({bis[(2H-1,3-benzodioxol-5-yl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 517.51 |
| Molecular Formula: | C28 H24 F N3 O6 |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)F)NC(c1coc(CN(Cc2ccc3c(c2)OCO3)Cc2ccc3c(c2)OCO3)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0744 |
| logD: | 4.0688 |
| logSw: | -4.2431 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.729 |
| InChI Key: | SJWAHGUEPKZSSE-UHFFFAOYSA-N |