N-(3-chlorophenyl)-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-chlorophenyl)-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
N-(3-chlorophenyl)-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M460-4027 |
| Compound Name: | N-(3-chlorophenyl)-2-[3-oxo-8-(4-phenylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 463.93 |
| Molecular Formula: | C23 H22 Cl N7 O2 |
| Smiles: | C1CN(CCN1C1C2=NN(CC(Nc3cccc(c3)[Cl])=O)C(N2C=CN=1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0431 |
| logD: | 3.0431 |
| logSw: | -3.4015 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.469 |
| InChI Key: | YKRGKNPGTCWTMK-UHFFFAOYSA-N |