N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide
Compound characteristics
| Compound ID: | C205-0095 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C20 H20 N2 O5 |
| Smiles: | Cc1ccc2c(c1)N(CCC(NCc1ccc3c(c1)OCO3)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1424 |
| logD: | 2.1424 |
| logSw: | -2.7273 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.634 |
| InChI Key: | AXBSHMQSHQREHQ-UHFFFAOYSA-N |