N-(3-cyanophenyl)-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-cyanophenyl)-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
N-(3-cyanophenyl)-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M460-4011 |
| Compound Name: | N-(3-cyanophenyl)-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 454.49 |
| Molecular Formula: | C24 H22 N8 O2 |
| Smiles: | C1CN(CCN1C1C2=NN(CC(Nc3cccc(C#N)c3)=O)C(N2C=CN=1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1505 |
| logD: | 2.1505 |
| logSw: | -3.0047 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.525 |
| InChI Key: | BCVUPJPOXYFUCZ-UHFFFAOYSA-N |