2,9-dimethyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2,9-dihydro-1H-pyrido[3,4-b]indol-1-one
Chemical Structure Depiction of
2,9-dimethyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2,9-dihydro-1H-pyrido[3,4-b]indol-1-one
2,9-dimethyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2,9-dihydro-1H-pyrido[3,4-b]indol-1-one
Compound characteristics
| Compound ID: | C225-0046 |
| Compound Name: | 2,9-dimethyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2,9-dihydro-1H-pyrido[3,4-b]indol-1-one |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H23 N5 O4 |
| Smiles: | CN1C=C(C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)c2c3ccccc3n(C)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.185 |
| logD: | 2.185 |
| logSw: | -2.4364 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.4 |
| InChI Key: | LJTGLHWLXVCGDV-UHFFFAOYSA-N |