6-chloro-3-[2-(furan-2-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-3-[2-(furan-2-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
6-chloro-3-[2-(furan-2-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | C301-1017 |
| Compound Name: | 6-chloro-3-[2-(furan-2-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 289.67 |
| Molecular Formula: | C14 H8 Cl N O4 |
| Smiles: | C(=C1/C(=O)Oc2ccc(cc2N1)[Cl])/C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9221 |
| logD: | 2.9122 |
| logSw: | -3.4755 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.973 |
| InChI Key: | SJQWGJDQVTYUAD-UHFFFAOYSA-N |