N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F119-0787 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C25 H22 N2 O5 |
| Smiles: | Cc1ccc(CN2C(COc3ccc(cc23)C(NCc2ccc3c(c2)OCO3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6827 |
| logD: | 3.6827 |
| logSw: | -3.9438 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.597 |
| InChI Key: | VKMWDRGDSQBHSA-UHFFFAOYSA-N |