N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E020-0544 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C23 H30 N6 O2 |
| Smiles: | CC1=NN(CC(NCCCN2CCN(CC2)Cc2ccccc2)=O)C(c2cccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1577 |
| logD: | 0.3381 |
| logSw: | -1.9012 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.135 |
| InChI Key: | OWUVGGRKOBNLQI-UHFFFAOYSA-N |