4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-propylbenzamide
Chemical Structure Depiction of
4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-propylbenzamide
4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-propylbenzamide
Compound characteristics
| Compound ID: | V024-5479 |
| Compound Name: | 4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-propylbenzamide |
| Molecular Weight: | 366.42 |
| Molecular Formula: | C21 H22 N2 O4 |
| Smiles: | CCCNC(c1ccc(CN2C(COc3ccc(cc23)C(C)=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.012 |
| logD: | 2.012 |
| logSw: | -2.6702 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.421 |
| InChI Key: | HBYRIXFSZFMSJM-UHFFFAOYSA-N |