3-[2-(4-methoxyphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
3-[2-(4-methoxyphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
3-[2-(4-methoxyphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
Compound ID: | 3141-0446 |
Compound Name: | 3-[2-(4-methoxyphenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one |
Molecular Weight: | 295.29 |
Molecular Formula: | C17 H13 N O4 |
Smiles: | COc1ccc(cc1)C(\C=C1/C(=O)Oc2ccccc2N1)=O |
Stereo: | ACHIRAL |
logP: | 3.2356 |
logD: | 3.2355 |
logSw: | -3.6745 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.938 |
InChI Key: | JKWVDPSNCHFRFM-UHFFFAOYSA-N |