4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide
Chemical Structure Depiction of
4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide
4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide
Compound characteristics
| Compound ID: | V014-7685 |
| Compound Name: | 4-[(6-acetyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C22 H24 N2 O4 |
| Smiles: | CCCCNC(c1ccc(CN2C(COc3ccc(cc23)C(C)=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5988 |
| logD: | 2.5988 |
| logSw: | -3.0171 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.421 |
| InChI Key: | ZWMDDPPDCCRCBD-UHFFFAOYSA-N |