C122H126F8N30O10 — CID 157283190
N-[4-(1-fluoroethoxy)phenyl]-5-[1-(3-fluoropiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide (PubChem CID 157283190) has the molecular formula C122H126F8N30O10 and a molecular weight of 2324.53 g/mol. Its IUPAC name is N-[4-(1-fluoroethoxy)phenyl]-5-[1-(3-fluoropiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide.
| Compound Name | N-[4-(1-fluoroethoxy)phenyl]-5-[1-(3-fluoropiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide |
|---|---|
| PubChem CID | 157283190 |
| Molecular Formula | C122H126F8N30O10 |
| Molecular Weight | 2324.53 g/mol |
| Exact Mass | 2323.01 |
| IUPAC Name | N-[4-(1-fluoroethoxy)phenyl]-5-[1-(3-fluoropiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-indazole-3-carboxamide;6-fluoro-N-[4-(1-fluoroethoxy)phenyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1H-indazole-3-carboxamide |
| SMILES | CC(F)Oc1ccc(NC(=O)c2n[nH]c3cc(F)c(-c4cnn(C5CCN(C)CC5)c4)cc23)cc1.CC(F)Oc1ccc(NC(=O)c2n[nH]c3cc(F)c(-c4cnn(C5CCNCC5)c4)cc23)cc1.CC(F)Oc1ccc(NC(=O)c2n[nH]c3ccc(-c4cnn(C5CCN(C)CC5)c4)cc23)cc1.CC(F)Oc1ccc(NC(=O)c2n[nH]c3ccc(-c4cnn(C5CCNCC5)c4)cc23)cc1.CC(F)Oc1ccc(NC(=O)c2n[nH]c3ccc(-c4cnn(C5CCNCC5F)c4)cc23)cc1 |
| InChI | InChI=1S/C25H26F2N6O2.C25H27FN6O2.2C24H24F2N6O2.C24H25FN6O2/c1-15(26)35-19-5-3-17(4-6-19)29-25(34)24-21-11-20(22(27)12-23(21)30-31-24)16-13-28-33(14-16)18-7-9-32(2)10-8-18;1-16(26)34-21-6-4-19(5-7-21)28-25(33)24-22-13-17(3-8-23(22)29-30-24)18-14-27-32(15-18)20-9-11-31(2)12-10-20;1-14(25)34-18-5-3-17(4-6-18)29-24(33)23-19-10-15(2-7-21(19)30-31-23)16-11-28-32(13-16)22-8-9-27-12-20(22)26;1-14(25)34-18-4-2-16(3-5-18)29-24(33)23-20-10-19(21(26)11-22(20)30-31-23)15-12-28-32(13-15)17-6-8-27-9-7-17;1-15(25)33-20-5-3-18(4-6-20)28-24(32)23-21-12-16(2-7-22(21)29-30-23)17-13-27-31(14-17)19-8-10-26-11-9-19/h3-6,11-15,18H,7-10H2,1-2H3,(H,29,34)(H,30,31);3-8,13-16,20H,9-12H2,1-2H3,(H,28,33)(H,29,30);2-7,10-11,13-14,20,22,27H,8-9,12H2,1H3,(H,29,33)(H,30,31);2-5,10-14,17,27H,6-9H2,1H3,(H,29,33)(H,30,31);2-7,12-15,19,26H,8-11H2,1H3,(H,28,32)(H,29,30) |
| InChIKey | AZXMBXHZCAMBTN-UHFFFAOYSA-N |
| XLogP | 22.40 |
| TPSA | 466.72 Ų |
| H-Bond Donors | 13 |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 30 |
| Heavy Atoms | 170 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2324.53 |
| LogP ≤ 5 | 22.40 |
| H-Bond Donors ≤ 5 | 13 |
| H-Bond Acceptors ≤ 10 | 30 |