4-[(4-fluorophenyl)methyl]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
4-[(4-fluorophenyl)methyl]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F119-0991 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 447.47 |
| Molecular Formula: | C24 H22 F N5 O3 |
| Smiles: | C1CN(CCN1C(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(CO2)=O)=O)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 2.5063 |
| logD: | 2.5062 |
| logSw: | -2.7721 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.339 |
| InChI Key: | GOQDIDFQFODERQ-UHFFFAOYSA-N |