N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide
Compound characteristics
| Compound ID: | F601-0787 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(4-methylphenyl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxamide |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C24 H20 N2 O5 |
| Smiles: | Cc1ccc(CN2C(=O)Oc3ccc(cc23)C(NCc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1276 |
| logD: | 4.1276 |
| logSw: | -4.3297 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.596 |
| InChI Key: | QCMQFLPLUWYWAC-UHFFFAOYSA-N |