5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazole-4-carbonitrile
5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y021-2270 |
| Compound Name: | 5-amino-1-(1,3-benzothiazol-2-yl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 241.27 |
| Molecular Formula: | C11 H7 N5 S |
| Smiles: | C(c1cnn(c1N)c1nc2ccccc2s1)#N |
| Stereo: | ACHIRAL |
| logP: | 2.3562 |
| logD: | 2.3562 |
| logSw: | -2.5217 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.146 |
| InChI Key: | QNGNVSDIXHKKFH-UHFFFAOYSA-N |