2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-1,3-oxazole-4-carboxamide
2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V019-4548 |
| Compound Name: | 2-({[(2H-1,3-benzodioxol-5-yl)methyl][(4-ethoxyphenyl)methyl]amino}methyl)-N-benzyl-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 499.57 |
| Molecular Formula: | C29 H29 N3 O5 |
| Salt: | not_available |
| Smiles: | CCOc1ccc(CN(Cc2ccc3c(c2)OCO3)Cc2nc(co2)C(NCc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5431 |
| logD: | 4.5429 |
| logSw: | -4.2645 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.737 |
| InChI Key: | ABCAUNRNFIZKJM-UHFFFAOYSA-N |