C216H138F18N10O10 — CID 157465982
4-[1,8-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[3,5-bis(trifluoromethyl)phenyl]-7-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[1-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione (PubChem CID 157465982) has the molecular formula C216H138F18N10O10 and a molecular weight of 3375.50 g/mol. Its IUPAC name is 4-[1,8-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[3,5-bis(trifluoromethyl)phenyl]-7-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[1-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione.
| Compound Name | 4-[1,8-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[3,5-bis(trifluoromethyl)phenyl]-7-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[1-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione |
|---|---|
| PubChem CID | 157465982 |
| Molecular Formula | C216H138F18N10O10 |
| Molecular Weight | 3375.50 g/mol |
| Exact Mass | 3373.03 |
| IUPAC Name | 4-[1,8-bis[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[3,5-bis(trifluoromethyl)phenyl]-7-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(3,5-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[1-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione |
| SMILES | Cc1cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c2C(=O)N(c2ccccc2-c2ccccc2)C3=O)cc(C(F)(F)F)c1.Cc1cc(-c2cccc3c4cccc(-c5cc(C)cc(C(F)(F)F)c5)c4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c23)cc(C(F)(F)F)c1.Cc1cc(-c2cccc3c4ccccc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c23)cc(C(F)(F)F)c1.Cc1cc(C)cc(-c2ccc3c4ccc(-c5cc(C(F)(F)F)cc(C(F)(F)F)c5)cc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c1.Cc1cc(C)cc(-c2ccc3c4ccccc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c1 |
| InChI | InChI=1S/2C48H30F6N2O2.2C40H25F3N2O2.C40H28N2O2/c1-27-21-30(25-32(23-27)47(49,50)51)35-14-8-16-37-38-17-9-15-36(31-22-28(2)24-33(26-31)48(52,53)54)44(38)55(43(35)37)41-20-10-18-39-42(41)46(58)56(45(39)57)40-19-7-6-13-34(40)29-11-4-3-5-12-29;1-27-19-28(2)21-32(20-27)30-15-17-37-38-18-16-31(33-22-34(47(49,50)51)26-35(23-33)48(52,53)54)25-43(38)55(42(37)24-30)41-14-8-12-39-44(41)46(58)56(45(39)57)40-13-7-6-11-36(40)29-9-4-3-5-10-29;1-24-21-26(23-27(22-24)40(41,42)43)29-15-9-16-31-30-14-6-8-19-34(30)44(37(29)31)35-20-10-17-32-36(35)39(47)45(38(32)46)33-18-7-5-13-28(33)25-11-3-2-4-12-25;1-24-20-27(22-28(21-24)40(41,42)43)26-18-19-35-32(23-26)30-13-6-8-16-34(30)44(35)36-17-9-14-31-37(36)39(47)45(38(31)46)33-15-7-5-12-29(33)25-10-3-2-4-11-25;1-25-21-26(2)23-29(22-25)28-19-20-32-31-14-7-9-17-35(31)41(37(32)24-28)36-18-10-15-33-38(36)40(44)42(39(33)43)34-16-8-6-13-30(34)27-11-4-3-5-12-27/h2*3-26H,1-2H3;2*2-23H,1H3;3-24H,1-2H3 |
| InChIKey | BUMGZEDVXBELFX-UHFFFAOYSA-N |
| XLogP | 56.51 |
| TPSA | 211.55 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 22 |
| Heavy Atoms | 254 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3375.50 |
| LogP ≤ 5 | 56.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |
| Structural Alerts | {'alert_name': 'phthalimide', 'substructure': 'N/A'} |
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