6-chloro-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
6-chloro-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | 5549-6057 |
| Compound Name: | 6-chloro-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 317.7 |
| Molecular Formula: | C16 H9 Cl F N O3 |
| Smiles: | C(=C1/C(=O)Oc2ccc(cc2N1)[Cl])/C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7821 |
| logD: | 3.7726 |
| logSw: | -4.3262 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.395 |
| InChI Key: | JOBMVVAVZPHBBI-UHFFFAOYSA-N |