2-ethyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]butanamide
Chemical Structure Depiction of
2-ethyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]butanamide
2-ethyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]butanamide
Compound characteristics
| Compound ID: | D519-0335 |
| Compound Name: | 2-ethyl-N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]butanamide |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C17 H22 N2 O3 |
| Smiles: | [H]N(C(C(CC)CC)=O)c1ccc2c(c1)N(CC=C)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5717 |
| logD: | 2.5713 |
| logSw: | -3.0908 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.681 |
| InChI Key: | XXARDKNSDFRMRI-UHFFFAOYSA-N |