1-{5-bromo-6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-bromo-6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one
1-{5-bromo-6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | C069-0936 |
| Compound Name: | 1-{5-bromo-6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one |
| Molecular Weight: | 492.43 |
| Molecular Formula: | C22 H26 Br N3 O3 S |
| Smiles: | CC1CN(CCN1c1ccc(C)cc1)S(c1cc2c(CCN2C(C)=O)cc1[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7711 |
| logD: | 3.7711 |
| logSw: | -3.882 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.846 |
| InChI Key: | WKXHTLDDZIAVMT-INIZCTEOSA-N |