6-amino-7-(1,3-benzothiazol-2-yl)-5-(2-phenylethyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
Chemical Structure Depiction of
6-amino-7-(1,3-benzothiazol-2-yl)-5-(2-phenylethyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
6-amino-7-(1,3-benzothiazol-2-yl)-5-(2-phenylethyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
Compound characteristics
| Compound ID: | 2798-1618 |
| Compound Name: | 6-amino-7-(1,3-benzothiazol-2-yl)-5-(2-phenylethyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile |
| Molecular Weight: | 421.48 |
| Molecular Formula: | C23 H15 N7 S |
| Smiles: | C(Cn1c(c(c2c1nc(C#N)c(C#N)n2)c1nc2ccccc2s1)N)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5481 |
| logD: | 4.5477 |
| logSw: | -4.7416 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.609 |
| InChI Key: | YWVWOCCKNDZPSU-UHFFFAOYSA-N |