2-[4-(4-phenylpiperazine-1-sulfonyl)phenyl]dihydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazole-1,3(2H)-dione
Chemical Structure Depiction of
2-[4-(4-phenylpiperazine-1-sulfonyl)phenyl]dihydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazole-1,3(2H)-dione
2-[4-(4-phenylpiperazine-1-sulfonyl)phenyl]dihydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8018-1030 |
| Compound Name: | 2-[4-(4-phenylpiperazine-1-sulfonyl)phenyl]dihydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazole-1,3(2H)-dione |
| Molecular Weight: | 441.51 |
| Molecular Formula: | C21 H23 N5 O4 S |
| Smiles: | C1CN2C(N(C(N2C1)=O)c1ccc(cc1)S(N1CCN(CC1)c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.005 |
| logD: | 2.005 |
| logSw: | -2.472 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.742 |
| InChI Key: | XBMQLDWATVFNQM-UHFFFAOYSA-N |