JWE
Summary
| Name: | 5-bromanyl-2-(2-fluoranylpyridin-4-yl)-1,7-naphthyridin-8-amine |
| Formula: | C13 H8 Br F N4 |
| Formal charge: | 0 |
| Formula weight: | 319.132 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-bromanyl-2-(2-fluoranylpyridin-4-yl)-1,7-naphthyridin-8-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H8BrFN4/c14-9-6-18-13(16)12-8(9)1-2-10(19-12)7-3-4-17-11(15)5-7/h1-6H,(H2,16,18) |
| InChIKey | InChI | 1.03 | KARJFNUGCLEZKM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ncc(Br)c2ccc(nc12)c3ccnc(F)c3 |
| SMILES | CACTVS | 3.385 | Nc1ncc(Br)c2ccc(nc12)c3ccnc(F)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(nc2c1c(cnc2N)Br)c3ccnc(c3)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(nc2c1c(cnc2N)Br)c3ccnc(c3)F |
