N-[2-(dimethylamino)ethyl]-4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide
N-[2-(dimethylamino)ethyl]-4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide
Compound characteristics
| Compound ID: | V022-4536 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}butanamide |
| Molecular Weight: | 467.57 |
| Molecular Formula: | C26 H33 N3 O5 |
| Salt: | not_available |
| Smiles: | CCc1ccccc1OCC(c1ccc2c(c1)N(CCCC(NCCN(C)C)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7479 |
| logD: | 0.2023 |
| logSw: | -2.3753 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.058 |
| InChI Key: | YWGQPFRQKSTAFU-UHFFFAOYSA-N |