Q1S
N-[2-(4-methylpiperazin-1-yl)-5-nitrophenyl]isoquinolin-1-amine
Find entries where: Q1S
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | N-[2-(4-methylpiperazin-1-yl)-5-nitrophenyl]isoquinolin-1-amine |
| Identifiers | ~{N}-[2-(4-methylpiperazin-1-yl)-5-nitro-phenyl]isoquinolin-1-amine |
| Formula | C20 H21 N5 O2 |
| Molecular Weight | 363.413 |
| Type | NON-POLYMER |
| Isomeric SMILES | CN1CCN(CC1)c2ccc(cc2Nc3c4ccccc4ccn3)[N+](=O)[O-] |
| InChI | InChI=1S/C20H21N5O2/c1-23-10-12-24(13-11-23)19-7-6-16(25(26)27)14-18(19)22-20-17-5-3-2-4-15(17)8-9-21-20/h2-9,14H,10-13H2,1H3,(H,21,22) |
| InChIKey | BAIHXTXZZNBSED-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 48 |
| Chiral Atom Count | 0 |
| Bond Count | 51 |
| Aromatic Bond Count | 17 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 145704702 |
