[8-(4-chlorophenyl)-3-(methanesulfonyl)-4-phenylpyrazolo[5,1-c][1,2,4]triazin-1(4H)-yl]acetonitrile
Chemical Structure Depiction of
[8-(4-chlorophenyl)-3-(methanesulfonyl)-4-phenylpyrazolo[5,1-c][1,2,4]triazin-1(4H)-yl]acetonitrile
[8-(4-chlorophenyl)-3-(methanesulfonyl)-4-phenylpyrazolo[5,1-c][1,2,4]triazin-1(4H)-yl]acetonitrile
Compound characteristics
| Compound ID: | Y021-2588 |
| Compound Name: | [8-(4-chlorophenyl)-3-(methanesulfonyl)-4-phenylpyrazolo[5,1-c][1,2,4]triazin-1(4H)-yl]acetonitrile |
| Molecular Weight: | 425.89 |
| Molecular Formula: | C20 H16 Cl N5 O2 S |
| Smiles: | CS(C1C(c2ccccc2)n2c(c(cn2)c2ccc(cc2)[Cl])N(CC#N)N=1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5867 |
| logD: | 3.5865 |
| logSw: | -4.1821 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.995 |
| InChI Key: | AITQIHSJPAJQQL-GOSISDBHSA-N |