2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-chlorophenyl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-chlorophenyl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-chlorophenyl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V022-8697 |
| Compound Name: | 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(2-chlorophenyl)methyl]amino}methyl)-N-[(4-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 507.95 |
| Molecular Formula: | C27 H23 Cl F N3 O4 |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)F)NC(c1coc(CN(Cc2ccc3c(c2)OCO3)Cc2ccccc2[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8412 |
| logD: | 4.8411 |
| logSw: | -5.0246 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.613 |
| InChI Key: | JXAHZODHXYPEDA-UHFFFAOYSA-N |