2-[(4-chlorophenyl)methylidene]-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-[(4-chlorophenyl)methylidene]-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
2-[(4-chlorophenyl)methylidene]-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F389-0090 |
| Compound Name: | 2-[(4-chlorophenyl)methylidene]-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 460.92 |
| Molecular Formula: | C25 H21 Cl N4 O3 |
| Smiles: | C1CN(CCN1C(c1ccc2c(c1)NC(/C(=C\c1ccc(cc1)[Cl])O2)=O)=O)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2412 |
| logD: | 4.2324 |
| logSw: | -4.9676 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.228 |
| InChI Key: | ASBTYCQWKDWHTG-UHFFFAOYSA-N |