3-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]benzonitrile
Chemical Structure Depiction of
3-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]benzonitrile
3-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]benzonitrile
Compound characteristics
| Compound ID: | P114-1154 |
| Compound Name: | 3-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]benzonitrile |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | Cn1cc(C2CCN(CC=2)S(c2cccc(C#N)c2)(=O)=O)c2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 2.734 |
| logD: | 2.7332 |
| logSw: | -3.1579 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.2 |
| InChI Key: | GQNPZSFVTPADMC-UHFFFAOYSA-N |