A1BU8
Summary
| Name: | 3-(4-methylpiperazin-1-yl)-5-(pyridin-4-yl)pyridazine |
| Formula: | C14 H17 N5 |
| Formal charge: | 0 |
| Formula weight: | 255.318 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 3-(4-methylpiperazin-1-yl)-5-(pyridin-4-yl)pyridazine |
| OpenEye OEToolkits | 3.1.0.0 | 3-(4-methylpiperazin-1-yl)-5-pyridin-4-yl-pyridazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CN1CCN(CC1)c1nncc(c1)c1ccncc1 |
| InChI | InChI | 1.06 | InChI=1S/C14H17N5/c1-18-6-8-19(9-7-18)14-10-13(11-16-17-14)12-2-4-15-5-3-12/h2-5,10-11H,6-9H2,1H3 |
| InChIKey | InChI | 1.06 | ABRBOSKOXBQLEU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1CCN(CC1)c2cc(cnn2)c3ccncc3 |
| SMILES | CACTVS | 3.385 | CN1CCN(CC1)c2cc(cnn2)c3ccncc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CN1CCN(CC1)c2cc(cnn2)c3ccncc3 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CN1CCN(CC1)c2cc(cnn2)c3ccncc3 |
