C132H95F6N21O9S — CID 162175247
N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide;(2S)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-pyridin-3-ylacetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-thiophen-2-ylacetamide (PubChem CID 162175247) has the molecular formula C132H95F6N21O9S and a molecular weight of 2265.40 g/mol. Its IUPAC name is N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide;(2S)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-pyridin-3-ylacetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-thiophen-2-ylacetamide.
| Compound Name | N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide;(2S)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-pyridin-3-ylacetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-thiophen-2-ylacetamide |
|---|---|
| PubChem CID | 162175247 |
| Molecular Formula | C132H95F6N21O9S |
| Molecular Weight | 2265.40 g/mol |
| Exact Mass | 2263.72 |
| IUPAC Name | N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)acetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)furan-2-carboxamide;(2S)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;(2R)-N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-5-oxopyrrolidine-2-carboxamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-pyridin-3-ylacetamide;N-(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)-2-thiophen-2-ylacetamide |
| SMILES | CC(=O)Nc1cc2c(-c3ccc4ccccc4c3)n[nH]c2cc1F.O=C(Cc1cccnc1)Nc1cc2c(-c3ccc4ccccc4c3)n[nH]c2cc1F.O=C(Cc1cccs1)Nc1cc2c(-c3ccc4ccccc4c3)n[nH]c2cc1F.O=C(Nc1cc2c(-c3ccc4ccccc4c3)n[nH]c2cc1F)c1ccco1.O=C1CC[C@@H](C(=O)Nc2cc3c(-c4ccc5ccccc5c4)n[nH]c3cc2F)N1.O=C1CC[C@H](C(=O)Nc2cc3c(-c4ccc5ccccc5c4)n[nH]c3cc2F)N1 |
| InChI | InChI=1S/C24H17FN4O.C23H16FN3OS.2C22H17FN4O2.C22H14FN3O2.C19H14FN3O/c25-20-13-21-19(12-22(20)27-23(30)10-15-4-3-9-26-14-15)24(29-28-21)18-8-7-16-5-1-2-6-17(16)11-18;24-19-13-20-18(12-21(19)25-22(28)11-17-6-3-9-29-17)23(27-26-20)16-8-7-14-4-1-2-5-15(14)10-16;2*23-16-11-18-15(10-19(16)25-22(29)17-7-8-20(28)24-17)21(27-26-18)14-6-5-12-3-1-2-4-13(12)9-14;23-17-12-18-16(11-19(17)24-22(27)20-6-3-9-28-20)21(26-25-18)15-8-7-13-4-1-2-5-14(13)10-15;1-11(24)21-18-9-15-17(10-16(18)20)22-23-19(15)14-7-6-12-4-2-3-5-13(12)8-14/h1-9,11-14H,10H2,(H,27,30)(H,28,29);1-10,12-13H,11H2,(H,25,28)(H,26,27);2*1-6,9-11,17H,7-8H2,(H,24,28)(H,25,29)(H,26,27);1-12H,(H,24,27)(H,25,26);2-10H,1H3,(H,21,24)(H,22,23)/t;;2*17-;;/m..10../s1 |
| InChIKey | ZOHRFLNEPCVZIB-BVNNDCCDSA-N |
| XLogP | 28.19 |
| TPSA | 430.91 Ų |
| H-Bond Donors | 14 |
| H-Bond Acceptors | 17 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 169 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2265.40 |
| LogP ≤ 5 | 28.19 |
| H-Bond Donors ≤ 5 | 14 |
| H-Bond Acceptors ≤ 10 | 17 |