1-(2H-1,3-benzodioxol-5-yl)-3-{[(2-chlorophenyl)methyl]amino}pyrazin-2(1H)-one
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-3-{[(2-chlorophenyl)methyl]amino}pyrazin-2(1H)-one
1-(2H-1,3-benzodioxol-5-yl)-3-{[(2-chlorophenyl)methyl]amino}pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G194-0823 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-3-{[(2-chlorophenyl)methyl]amino}pyrazin-2(1H)-one |
| Molecular Weight: | 355.78 |
| Molecular Formula: | C18 H14 Cl N3 O3 |
| Smiles: | C(c1ccccc1[Cl])NC1C(N(C=CN=1)c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4158 |
| logD: | 2.4154 |
| logSw: | -3.1748 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.417 |
| InChI Key: | REOJDQCMULTZAA-UHFFFAOYSA-N |