1-benzyl-2-methyl-3-[1-(3-nitrobenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indole
Chemical Structure Depiction of
1-benzyl-2-methyl-3-[1-(3-nitrobenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indole
1-benzyl-2-methyl-3-[1-(3-nitrobenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indole
Compound characteristics
| Compound ID: | C614-0743 |
| Compound Name: | 1-benzyl-2-methyl-3-[1-(3-nitrobenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indole |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C27 H25 N3 O4 S |
| Smiles: | Cc1c(C2CCN(CC=2)S(c2cccc(c2)[N+]([O-])=O)(=O)=O)c2ccccc2n1Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8522 |
| logD: | 5.8522 |
| logSw: | -5.9384 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.26 |
| InChI Key: | DKRJAVPPXZLFSS-UHFFFAOYSA-N |