4-(4-{[3-(3,5-dimethylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-sulfonyl)-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-(4-{[3-(3,5-dimethylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-sulfonyl)-2,1,3-benzothiadiazole
4-(4-{[3-(3,5-dimethylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-sulfonyl)-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | L680-0264 |
| Compound Name: | 4-(4-{[3-(3,5-dimethylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-sulfonyl)-2,1,3-benzothiadiazole |
| Molecular Weight: | 519.65 |
| Molecular Formula: | C25 H25 N7 O2 S2 |
| Smiles: | Cc1cc(C)cc(c1)n1c(CN2CCN(CC2)S(c2cccc3c2nsn3)(=O)=O)nc2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 3.8191 |
| logD: | 3.779 |
| logSw: | -3.8778 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.997 |
| InChI Key: | XYMODWPYTDSDSI-UHFFFAOYSA-N |