4-{6-[(2,5-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyridin-2-yl)ethyl]butanamide
Chemical Structure Depiction of
4-{6-[(2,5-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyridin-2-yl)ethyl]butanamide
4-{6-[(2,5-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyridin-2-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | V006-2457 |
| Compound Name: | 4-{6-[(2,5-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(pyridin-2-yl)ethyl]butanamide |
| Molecular Weight: | 501.58 |
| Molecular Formula: | C29 H31 N3 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(c1)OCC(c1ccc2c(c1)N(CCCC(NCCc1ccccn1)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4646 |
| logD: | 2.4597 |
| logSw: | -2.7762 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.464 |
| InChI Key: | LLHPLEHMUAEYQW-UHFFFAOYSA-N |