FQK
Summary
| Name: | 8-[4-[1-(cyclobutylmethyl)piperidin-4-yl]pyrazol-1-yl]-3~{H}-pyrido[3,4-d]pyrimidin-4-one |
| Formula: | C20 H24 N6 O |
| Formal charge: | 0 |
| Formula weight: | 364.444 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 8-[4-[1-(cyclobutylmethyl)piperidin-4-yl]pyrazol-1-yl]-3~{H}-pyrido[3,4-d]pyrimidin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C20H24N6O/c27-20-17-4-7-21-19(18(17)22-13-23-20)26-12-16(10-24-26)15-5-8-25(9-6-15)11-14-2-1-3-14/h4,7,10,12-15H,1-3,5-6,8-9,11H2,(H,22,23,27) |
| InChIKey | InChI | 1.03 | FQYVJQRHNLIPIK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NC=Nc2c1ccnc2n3cc(cn3)C4CCN(CC4)CC5CCC5 |
| SMILES | CACTVS | 3.385 | O=C1NC=Nc2c1ccnc2n3cc(cn3)C4CCN(CC4)CC5CCC5 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cnc(c2c1C(=O)NC=N2)n3cc(cn3)C4CCN(CC4)CC5CCC5 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cnc(c2c1C(=O)NC=N2)n3cc(cn3)C4CCN(CC4)CC5CCC5 |
