1-{5-bromo-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-bromo-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one
1-{5-bromo-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | C069-0835 |
| Compound Name: | 1-{5-bromo-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-2,3-dihydro-1H-indol-1-yl}ethan-1-one |
| Molecular Weight: | 509.38 |
| Molecular Formula: | C20 H21 Br N4 O5 S |
| Smiles: | CC(N1CCc2cc(c(cc12)S(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1099 |
| logD: | 3.1099 |
| logSw: | -3.6133 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.009 |
| InChI Key: | VXFSUXMRYMQSOF-UHFFFAOYSA-N |