5-amino-1-benzoyl-1H-pyrazole-3,4-dicarbonitrile
Chemical Structure Depiction of
5-amino-1-benzoyl-1H-pyrazole-3,4-dicarbonitrile
5-amino-1-benzoyl-1H-pyrazole-3,4-dicarbonitrile
Compound characteristics
| Compound ID: | 8015-6958 |
| Compound Name: | 5-amino-1-benzoyl-1H-pyrazole-3,4-dicarbonitrile |
| Molecular Weight: | 237.22 |
| Molecular Formula: | C12 H7 N5 O |
| Smiles: | C(c1c(C#N)nn(C(c2ccccc2)=O)c1N)#N |
| Stereo: | ACHIRAL |
| logP: | 0.5886 |
| logD: | 0.5886 |
| logSw: | -1.3826 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.905 |
| InChI Key: | UQWDIGVBCSPLAK-UHFFFAOYSA-N |