6-chloro-3-(2-oxo-4-phenylbut-3-en-1-ylidene)-3,4-dihydro-2H-1,4-benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-3-(2-oxo-4-phenylbut-3-en-1-ylidene)-3,4-dihydro-2H-1,4-benzoxazin-2-one
6-chloro-3-(2-oxo-4-phenylbut-3-en-1-ylidene)-3,4-dihydro-2H-1,4-benzoxazin-2-one
Compound characteristics
| Compound ID: | 5549-6068 |
| Compound Name: | 6-chloro-3-(2-oxo-4-phenylbut-3-en-1-ylidene)-3,4-dihydro-2H-1,4-benzoxazin-2-one |
| Molecular Weight: | 325.75 |
| Molecular Formula: | C18 H12 Cl N O3 |
| Smiles: | C(=C/c1ccccc1)\C(\C=C1/C(=O)Oc2ccc(cc2N1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2627 |
| logD: | 4.1605 |
| logSw: | -4.6477 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.903 |
| InChI Key: | HBVLDVCTDNNQIH-UHFFFAOYSA-N |