4-benzyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-benzyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
4-benzyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F119-0109 |
| Compound Name: | 4-benzyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 429.48 |
| Molecular Formula: | C24 H23 N5 O3 |
| Smiles: | C1CN(CCN1C(c1ccc2c(c1)N(Cc1ccccc1)C(CO2)=O)=O)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 2.4772 |
| logD: | 2.4772 |
| logSw: | -2.8741 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.339 |
| InChI Key: | MPJDDDGHPSHHQE-UHFFFAOYSA-N |