3-{4-[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]piperazine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
3-{4-[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]piperazine-1-sulfonyl}benzonitrile
3-{4-[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]piperazine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | M513-1925 |
| Compound Name: | 3-{4-[2-(1-ethyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]piperazine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 423.54 |
| Molecular Formula: | C22 H25 N5 O2 S |
| Smiles: | CCn1cc(CCN2CCN(CC2)S(c2cccc(C#N)c2)(=O)=O)c2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 2.0268 |
| logD: | 1.9839 |
| logSw: | -2.4666 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.16 |
| InChI Key: | SYDPOQPKSPKLDN-UHFFFAOYSA-N |