C162H159F5N8O26 — CID 160519184
4-[2-(4-fluorophenyl)oxolan-2-yl]-N-[[4-(2-hydroxyacetyl)phenyl]methyl]benzamide;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[4-(2-hydroxyacetyl)phenyl]methyl]pyridin-2-one;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[5-(2-hydroxyacetyl)-2-pyridinyl]methyl]pyridin-2-one;4-[2-[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]ethyl]-N-hydroxybenzamide;4-[[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]methyl]-N-hydroxybenzamide;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-methyloxolan-2-yl)pyridin-2-one;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-propan-2-yloxolan-2-yl)pyridin-2-one (PubChem CID 160519184) has the molecular formula C162H159F5N8O26 and a molecular weight of 2729.07 g/mol. Its IUPAC name is 4-[2-(4-fluorophenyl)oxolan-2-yl]-N-[[4-(2-hydroxyacetyl)phenyl]methyl]benzamide;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[4-(2-hydroxyacetyl)phenyl]methyl]pyridin-2-one;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[5-(2-hydroxyacetyl)-2-pyridinyl]methyl]pyridin-2-one;4-[2-[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]ethyl]-N-hydroxybenzamide;4-[[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]methyl]-N-hydroxybenzamide;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-methyloxolan-2-yl)pyridin-2-one;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-propan-2-yloxolan-2-yl)pyridin-2-one.
| Compound Name | 4-[2-(4-fluorophenyl)oxolan-2-yl]-N-[[4-(2-hydroxyacetyl)phenyl]methyl]benzamide;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[4-(2-hydroxyacetyl)phenyl]methyl]pyridin-2-one;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[5-(2-hydroxyacetyl)-2-pyridinyl]methyl]pyridin-2-one;4-[2-[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]ethyl]-N-hydroxybenzamide;4-[[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]methyl]-N-hydroxybenzamide;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-methyloxolan-2-yl)pyridin-2-one;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-propan-2-yloxolan-2-yl)pyridin-2-one |
|---|---|
| PubChem CID | 160519184 |
| Molecular Formula | C162H159F5N8O26 |
| Molecular Weight | 2729.07 g/mol |
| Exact Mass | 2727.13 |
| IUPAC Name | 4-[2-(4-fluorophenyl)oxolan-2-yl]-N-[[4-(2-hydroxyacetyl)phenyl]methyl]benzamide;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[4-(2-hydroxyacetyl)phenyl]methyl]pyridin-2-one;4-[2-(4-fluorophenyl)oxolan-2-yl]-1-[[5-(2-hydroxyacetyl)-2-pyridinyl]methyl]pyridin-2-one;4-[2-[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]ethyl]-N-hydroxybenzamide;4-[[4-[2-(4-fluorophenyl)oxolan-2-yl]phenyl]methyl]-N-hydroxybenzamide;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-methyloxolan-2-yl)pyridin-2-one;1-[[4-(2-hydroxyacetyl)phenyl]methyl]-4-(2-propan-2-yloxolan-2-yl)pyridin-2-one |
| SMILES | CC(C)C1(c2ccn(Cc3ccc(C(=O)CO)cc3)c(=O)c2)CCCO1.CC1(c2ccn(Cc3ccc(C(=O)CO)cc3)c(=O)c2)CCCO1.O=C(CO)c1ccc(CNC(=O)c2ccc(C3(c4ccc(F)cc4)CCCO3)cc2)cc1.O=C(CO)c1ccc(Cn2ccc(C3(c4ccc(F)cc4)CCCO3)cc2=O)cc1.O=C(CO)c1ccc(Cn2ccc(C3(c4ccc(F)cc4)CCCO3)cc2=O)nc1.O=C(NO)c1ccc(CCc2ccc(C3(c4ccc(F)cc4)CCCO3)cc2)cc1.O=C(NO)c1ccc(Cc2ccc(C3(c4ccc(F)cc4)CCCO3)cc2)cc1 |
| InChI | InChI=1S/C26H24FNO4.C25H24FNO3.C24H22FNO4.C24H22FNO3.C23H21FN2O4.C21H25NO4.C19H21NO4/c27-23-12-10-22(11-13-23)26(14-1-15-32-26)21-8-6-20(7-9-21)25(31)28-16-18-2-4-19(5-3-18)24(30)17-29;26-23-14-12-22(13-15-23)25(16-1-17-30-25)21-10-6-19(7-11-21)3-2-18-4-8-20(9-5-18)24(28)27-29;25-21-8-6-19(7-9-21)24(11-1-13-30-24)20-10-12-26(23(29)14-20)15-17-2-4-18(5-3-17)22(28)16-27;25-22-12-10-21(11-13-22)24(14-1-15-29-24)20-8-4-18(5-9-20)16-17-2-6-19(7-3-17)23(27)26-28;24-19-5-3-17(4-6-19)23(9-1-11-30-23)18-8-10-26(22(29)12-18)14-20-7-2-16(13-25-20)21(28)15-27;1-15(2)21(9-3-11-26-21)18-8-10-22(20(25)12-18)13-16-4-6-17(7-5-16)19(24)14-23;1-19(8-2-10-24-19)16-7-9-20(18(23)11-16)12-14-3-5-15(6-4-14)17(22)13-21/h2-13,29H,1,14-17H2,(H,28,31);4-15,29H,1-3,16-17H2,(H,27,28);2-10,12,14,27H,1,11,13,15-16H2;2-13,28H,1,14-16H2,(H,26,27);2-8,10,12-13,27H,1,9,11,14-15H2;4-8,10,12,15,23H,3,9,11,13-14H2,1-2H3;3-7,9,11,21H,2,8,10,12-13H2,1H3 |
| InChIKey | QUAYEADEHZUSBT-UHFFFAOYSA-N |
| XLogP | 24.11 |
| TPSA | 479.76 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 31 |
| Rotatable Bonds | 41 |
| Heavy Atoms | 201 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2729.07 |
| LogP ≤ 5 | 24.11 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 31 |
| Structural Alerts | {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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