1-{4-[4-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one
1-{4-[4-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | C069-0878 |
| Compound Name: | 1-{4-[4-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)piperazin-1-yl]phenyl}ethan-1-one |
| Molecular Weight: | 506.42 |
| Molecular Formula: | C22 H24 Br N3 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1cc2c(CCN2C(C)=O)cc1[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7263 |
| logD: | 2.7263 |
| logSw: | -3.297 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.455 |
| InChI Key: | ZCZRJIWUQBRULF-UHFFFAOYSA-N |