C92H73ClF24N26O3 — CID 159204752
6-(6-chloro-2-ethylimidazo[4,5-b]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N-[4-(difluoromethoxy)phenyl]-6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;[6-fluoro-3-[6-[4-(trifluoromethyl)anilino]pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]methanol (PubChem CID 159204752) has the molecular formula C92H73ClF24N26O3 and a molecular weight of 2082.18 g/mol. Its IUPAC name is 6-(6-chloro-2-ethylimidazo[4,5-b]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N-[4-(difluoromethoxy)phenyl]-6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;[6-fluoro-3-[6-[4-(trifluoromethyl)anilino]pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]methanol.
| Compound Name | 6-(6-chloro-2-ethylimidazo[4,5-b]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N-[4-(difluoromethoxy)phenyl]-6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;[6-fluoro-3-[6-[4-(trifluoromethyl)anilino]pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]methanol |
|---|---|
| PubChem CID | 159204752 |
| Molecular Formula | C92H73ClF24N26O3 |
| Molecular Weight | 2082.18 g/mol |
| Exact Mass | 2080.57 |
| IUPAC Name | 6-(6-chloro-2-ethylimidazo[4,5-b]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N-[4-(difluoromethoxy)phenyl]-6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;[6-fluoro-3-[6-[4-(trifluoromethyl)anilino]pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]methanol |
| SMILES | CCc1nc2ncc(Cl)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.CCn1nc(C(F)(F)F)c(-c2cncc(Nc3ccc(C(F)(F)F)cc3)n2)c1C.CCn1nc(C(F)(F)F)c(-c2cncc(Nc3ccc(OC(F)(F)F)cc3)n2)c1C.CCn1nc(C(F)(F)F)c(-c2cncc(Nc3ccc(OC(F)F)cc3)n2)c1C.OCc1nc2ccc(F)cn2c1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1 |
| InChI | InChI=1S/C19H14ClF3N6.C19H13F4N5O.C18H15F6N5O.C18H15F6N5.C18H16F5N5O/c1-2-16-28-18-14(7-12(20)8-25-18)29(16)17-10-24-9-15(27-17)26-13-5-3-11(4-6-13)19(21,22)23;20-12-3-6-17-27-15(10-29)18(28(17)9-12)14-7-24-8-16(26-14)25-13-4-1-11(2-5-13)19(21,22)23;1-3-29-10(2)15(16(28-29)17(19,20)21)13-8-25-9-14(27-13)26-11-4-6-12(7-5-11)30-18(22,23)24;1-3-29-10(2)15(16(28-29)18(22,23)24)13-8-25-9-14(27-13)26-12-6-4-11(5-7-12)17(19,20)21;1-3-28-10(2)15(16(27-28)18(21,22)23)13-8-24-9-14(26-13)25-11-4-6-12(7-5-11)29-17(19)20/h3-10H,2H2,1H3,(H,26,27);1-9,29H,10H2,(H,25,26);4-9H,3H2,1-2H3,(H,26,27);4-9H,3H2,1-2H3,(H,26,27);4-9,17H,3H2,1-2H3,(H,25,26) |
| InChIKey | KPSTVMFEMSXXBK-UHFFFAOYSA-N |
| XLogP | 25.19 |
| TPSA | 329.21 Ų |
| H-Bond Donors | 6 |
| H-Bond Acceptors | 29 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 146 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2082.18 |
| LogP ≤ 5 | 25.19 |
| H-Bond Donors ≤ 5 | 6 |
| H-Bond Acceptors ≤ 10 | 29 |