6-amino-7-(1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
Chemical Structure Depiction of
6-amino-7-(1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
6-amino-7-(1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
Compound characteristics
| Compound ID: | 5830-0010 |
| Compound Name: | 6-amino-7-(1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile |
| Molecular Weight: | 427.87 |
| Molecular Formula: | C21 H10 Cl N7 S |
| Smiles: | C(c1c(C#N)nc2c(c(c(N)n2c2ccc(cc2)[Cl])c2nc3ccccc3s2)n1)#N |
| Stereo: | ACHIRAL |
| logP: | 4.7874 |
| logD: | 4.7873 |
| logSw: | -5.2949 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.373 |
| InChI Key: | GCBWQTATMSRLRY-UHFFFAOYSA-N |