2-[(3-chlorophenyl)methylidene]-N-[2-(1H-imidazol-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)methylidene]-N-[2-(1H-imidazol-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
2-[(3-chlorophenyl)methylidene]-N-[2-(1H-imidazol-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F389-0641 |
| Compound Name: | 2-[(3-chlorophenyl)methylidene]-N-[2-(1H-imidazol-4-yl)ethyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 408.84 |
| Molecular Formula: | C21 H17 Cl N4 O3 |
| Smiles: | C(CNC(c1ccc2c(c1)NC(/C(=C\c1cccc(c1)[Cl])O2)=O)=O)c1c[nH]cn1 |
| Stereo: | ACHIRAL |
| logP: | 2.7956 |
| logD: | 2.7912 |
| logSw: | -3.7386 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.856 |
| InChI Key: | KPKQNCVLMQAUHD-UHFFFAOYSA-N |