4-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-2H-1,4-benzoxazin-3(4H)-one
4-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | K786-6178 |
| Compound Name: | 4-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C22 H24 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(CCN1C(COc2ccccc12)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1025 |
| logD: | 3.1025 |
| logSw: | -3.353 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.398 |
| InChI Key: | UPIFTJDLPGGRQO-UHFFFAOYSA-N |