4-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole
4-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | P114-1082 |
| Compound Name: | 4-[4-(1-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C19 H17 N5 O2 S2 |
| Smiles: | Cn1cc(C2CCN(CC=2)S(c2cccc3c2nsn3)(=O)=O)c2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 3.0125 |
| logD: | 3.0117 |
| logSw: | -3.2634 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.097 |
| InChI Key: | PQCLRISZXHHPAH-UHFFFAOYSA-N |