3-[1-(2,5-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1-methyl-1H-pyrrolo[2,3-b]pyridine
Chemical Structure Depiction of
3-[1-(2,5-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1-methyl-1H-pyrrolo[2,3-b]pyridine
3-[1-(2,5-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1-methyl-1H-pyrrolo[2,3-b]pyridine
Compound characteristics
| Compound ID: | P114-1084 |
| Compound Name: | 3-[1-(2,5-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1-methyl-1H-pyrrolo[2,3-b]pyridine |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C21 H23 N3 O2 S |
| Smiles: | Cc1ccc(C)c(c1)S(N1CCC(=CC1)c1cn(C)c2c1cccn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8532 |
| logD: | 3.8524 |
| logSw: | -3.6839 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.144 |
| InChI Key: | USGAXOXNIJWUEW-UHFFFAOYSA-N |