4-[4-(1-ethyl-2-methyl-1H-indol-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-[4-(1-ethyl-2-methyl-1H-indol-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole
4-[4-(1-ethyl-2-methyl-1H-indol-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | C614-0753 |
| Compound Name: | 4-[4-(1-ethyl-2-methyl-1H-indol-3-yl)-3,6-dihydropyridine-1(2H)-sulfonyl]-2,1,3-benzothiadiazole |
| Molecular Weight: | 438.57 |
| Molecular Formula: | C22 H22 N4 O2 S2 |
| Smiles: | CCn1c(C)c(C2CCN(CC=2)S(c2cccc3c2nsn3)(=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.7471 |
| logD: | 4.7471 |
| logSw: | -4.775 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.827 |
| InChI Key: | ROKHLUUVLOKNFK-UHFFFAOYSA-N |