2-[(4-chlorophenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-[(4-chlorophenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
2-[(4-chlorophenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F389-0055 |
| Compound Name: | 2-[(4-chlorophenyl)methylidene]-6-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 487.99 |
| Molecular Formula: | C28 H26 Cl N3 O3 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc2c(c1)NC(/C(=C/c1ccc(cc1)[Cl])O2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7316 |
| logD: | 5.7315 |
| logSw: | -6.1464 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.415 |
| InChI Key: | RODFRRQZGXSQJH-UHFFFAOYSA-N |