4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide
Chemical Structure Depiction of
4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide
4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | V022-4505 |
| Compound Name: | 4-{6-[(2-ethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide |
| Molecular Weight: | 493.6 |
| Molecular Formula: | C28 H35 N3 O5 |
| Salt: | not_available |
| Smiles: | CCc1ccccc1OCC(c1ccc2c(c1)N(CCCC(NCCN1CCCC1)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.227 |
| logD: | 0.0714 |
| logSw: | -2.8231 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.269 |
| InChI Key: | KPPQCZWZRUFFSW-UHFFFAOYSA-N |