1-(4-bromoanilino)-3-{2-methyl-3-[1-(4-methylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}propan-2-ol
Chemical Structure Depiction of
1-(4-bromoanilino)-3-{2-methyl-3-[1-(4-methylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}propan-2-ol
1-(4-bromoanilino)-3-{2-methyl-3-[1-(4-methylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}propan-2-ol
Compound characteristics
| Compound ID: | C614-1039 |
| Compound Name: | 1-(4-bromoanilino)-3-{2-methyl-3-[1-(4-methylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}propan-2-ol |
| Molecular Weight: | 594.57 |
| Molecular Formula: | C30 H32 Br N3 O3 S |
| Smiles: | Cc1ccc(cc1)S(N1CCC(=CC1)c1c2ccccc2n(CC(CNc2ccc(cc2)[Br])O)c1C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7074 |
| logD: | 6.7074 |
| logSw: | -5.8848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.004 |
| InChI Key: | VKBOLGPGBGZMBX-SANMLTNESA-N |