2-[(3-chlorophenyl)methylidene]-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-[(3-chlorophenyl)methylidene]-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one
2-[(3-chlorophenyl)methylidene]-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-5306 |
| Compound Name: | 2-[(3-chlorophenyl)methylidene]-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 473.96 |
| Molecular Formula: | C27 H24 Cl N3 O3 |
| Smiles: | C1CN(CCN1C(CN1C(/C(=C\c2cccc(c2)[Cl])Oc2ccccc12)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.523 |
| logD: | 4.5229 |
| logSw: | -4.7803 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.686 |
| InChI Key: | ZIKLYAZVVWZHFR-UHFFFAOYSA-N |