C163H144ClF2N13O9 — CID 163562375
4-(4-butylphenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-fluorophenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-fluorophenyl)-N-phenylbenzamide;4-(4-methoxyphenyl)-N-phenylbenzamide;N-[4-(methylamino)phenyl]-4-(4-methylphenyl)benzamide;4-(4-methylphenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-methylphenyl)-N-phenylbenzamide (PubChem CID 163562375) has the molecular formula C163H144ClF2N13O9 and a molecular weight of 2502.48 g/mol. Its IUPAC name is 4-(4-butylphenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-fluorophenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-fluorophenyl)-N-phenylbenzamide;4-(4-methoxyphenyl)-N-phenylbenzamide;N-[4-(methylamino)phenyl]-4-(4-methylphenyl)benzamide;4-(4-methylphenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-methylphenyl)-N-phenylbenzamide.
| Compound Name | 4-(4-butylphenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-fluorophenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-fluorophenyl)-N-phenylbenzamide;4-(4-methoxyphenyl)-N-phenylbenzamide;N-[4-(methylamino)phenyl]-4-(4-methylphenyl)benzamide;4-(4-methylphenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-methylphenyl)-N-phenylbenzamide |
|---|---|
| PubChem CID | 163562375 |
| Molecular Formula | C163H144ClF2N13O9 |
| Molecular Weight | 2502.48 g/mol |
| Exact Mass | 2500.09 |
| IUPAC Name | 4-(4-butylphenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-fluorophenyl)-N-[4-(methylamino)phenyl]benzamide;4-(4-fluorophenyl)-N-phenylbenzamide;4-(4-methoxyphenyl)-N-phenylbenzamide;N-[4-(methylamino)phenyl]-4-(4-methylphenyl)benzamide;4-(4-methylphenyl)-N-(6-methyl-3-pyridinyl)benzamide;4-(4-methylphenyl)-N-phenylbenzamide |
| SMILES | CCCCc1ccc(-c2ccc(C(=O)Nc3ccc(NC)cc3)cc2)cc1.CNc1ccc(NC(=O)c2ccc(-c3ccc(C)cc3)cc2)cc1.CNc1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)cc2)cc1.COc1ccc(-c2ccc(C(=O)Nc3ccccc3)cc2)cc1.Cc1ccc(-c2ccc(C(=O)Nc3ccc(C)nc3)cc2)cc1.Cc1ccc(-c2ccc(C(=O)Nc3ccccc3)cc2)cc1.Cc1ccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)cn1.O=C(Nc1ccccc1)c1ccc(-c2ccc(F)cc2)cc1 |
| InChI | InChI=1S/C24H26N2O.C21H20N2O.C20H17FN2O.C20H18N2O.C20H17NO2.C20H17NO.C19H15ClN2O.C19H14FNO/c1-3-4-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)24(27)26-23-16-14-22(25-2)15-17-23;1-15-3-5-16(6-4-15)17-7-9-18(10-8-17)21(24)23-20-13-11-19(22-2)12-14-20;1-22-18-10-12-19(13-11-18)23-20(24)16-4-2-14(3-5-16)15-6-8-17(21)9-7-15;1-14-3-6-16(7-4-14)17-8-10-18(11-9-17)20(23)22-19-12-5-15(2)21-13-19;1-23-19-13-11-16(12-14-19)15-7-9-17(10-8-15)20(22)21-18-5-3-2-4-6-18;1-15-7-9-16(10-8-15)17-11-13-18(14-12-17)20(22)21-19-5-3-2-4-6-19;1-13-2-11-18(12-21-13)22-19(23)16-5-3-14(4-6-16)15-7-9-17(20)10-8-15;20-17-12-10-15(11-13-17)14-6-8-16(9-7-14)19(22)21-18-4-2-1-3-5-18/h6-17,25H,3-5H2,1-2H3,(H,26,27);3-14,22H,1-2H3,(H,23,24);2-13,22H,1H3,(H,23,24);3-13H,1-2H3,(H,22,23);2-14H,1H3,(H,21,22);2-14H,1H3,(H,21,22);2-12H,1H3,(H,22,23);1-13H,(H,21,22) |
| InChIKey | FSHSBZWXUNEZKQ-UHFFFAOYSA-N |
| XLogP | 39.59 |
| TPSA | 303.90 Ų |
| H-Bond Donors | 11 |
| H-Bond Acceptors | 14 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 188 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2502.48 |
| LogP ≤ 5 | 39.59 |
| H-Bond Donors ≤ 5 | 11 |
| H-Bond Acceptors ≤ 10 | 14 |