(4,5-dihydro-1H-benzo[g]indazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(4,5-dihydro-1H-benzo[g]indazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
(4,5-dihydro-1H-benzo[g]indazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | G365-0044 |
| Compound Name: | (4,5-dihydro-1H-benzo[g]indazol-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C22 H21 N5 O3 |
| Smiles: | C1Cc2c(C(N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)=O)n[nH]c2c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.7727 |
| logD: | 3.7725 |
| logSw: | -4.1912 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.571 |
| InChI Key: | LTTOYSLWMXKPNU-UHFFFAOYSA-N |