5-bromo-1-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-1H-indole-2,3-dione
Chemical Structure Depiction of
5-bromo-1-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-1H-indole-2,3-dione
5-bromo-1-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-1H-indole-2,3-dione
Compound characteristics
| Compound ID: | K028-0018 |
| Compound Name: | 5-bromo-1-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-1H-indole-2,3-dione |
| Molecular Weight: | 414.3 |
| Molecular Formula: | C20 H20 Br N3 O2 |
| Smiles: | Cc1cccc(c1)N1CCN(CC1)CN1C(C(c2cc(ccc12)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8603 |
| logD: | 3.8549 |
| logSw: | -3.8446 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.54 |
| InChI Key: | HGVKKTPAEKDXQR-UHFFFAOYSA-N |