N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2-(4-oxoquinazolin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2-(4-oxoquinazolin-3(4H)-yl)acetamide
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2-(4-oxoquinazolin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | K979-0334 |
| Compound Name: | N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2-(4-oxoquinazolin-3(4H)-yl)acetamide |
| Molecular Weight: | 463.49 |
| Molecular Formula: | C24 H25 N5 O5 |
| Smiles: | C(C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)NC(CN1C=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.416 |
| logD: | 0.2244 |
| logSw: | -2.4854 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.859 |
| InChI Key: | LSFQRACEUDLRHV-UHFFFAOYSA-N |