4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione

C123H75F15N10O10 — CID 160528195

IUPAC4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione
SMILESCN1C(=O)c2cccc(-n3c4cccc(C(F)(F)F)c4c4c(C(F)(F)F)cccc43)c2C1=O.CN1C(=O)c2cccc(-n3c4ccccc4c4c(C(F)(F)F)cccc43)c2C1=O.Cc1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1cccc2c1C(=O)N(C)C2=O.Cc1cccc2c3cccc(C(F)(F)F)c3n(-c3cccc4c3C(=O)N(c3ccccc3)C4=O)c12.Cc1cccc2c3ccccc3n(-c3cccc4c3C(=O)N(c3ccccc3)C4=O)c12
InChIInChI=1S/C28H17F3N2O2.C27H18N2O2.C23H12F6N2O2.C23H15F3N2O2.C22H13F3N2O2/c1-16-8-5-11-18-19-12-6-14-21(28(29,30)31)25(19)33(24(16)18)22-15-7-13-20-23(22)27(35)32(26(20)34)17-9-3-2-4-10-17;1-17-9-7-13-20-19-12-5-6-15-22(19)29(25(17)20)23-16-8-14-21-24(23)27(31)28(26(21)30)18-10-3-2-4-11-18;1-30-20(32)11-5-2-8-14(17(11)21(30)33)31-15-9-3-6-12(22(24,25)26)18(15)19-13(23(27,28)29)7-4-10-16(19)31;1-12-6-8-17-15(10-12)16-11-13(23(24,25)26)7-9-18(16)28(17)19-5-3-4-14-20(19)22(30)27(2)21(14)29;1-26-20(28)13-7-4-10-17(19(13)21(26)29)27-15-9-3-2-6-12(15)18-14(22(23,24)25)8-5-11-16(18)27/h2-15H,1H3;2-16H,1H3;2-10H,1H3;3-11H,1-2H3;2-11H,1H3
InChIKeyQVEMLUOCJMKYOH-UHFFFAOYSA-N
MW2137.98 g/mol
LogP29.22
Rot. Bonds7

About 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione

4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione (PubChem CID 160528195) has the molecular formula C123H75F15N10O10 and a molecular weight of 2137.98 g/mol. Its IUPAC name is 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione.

Molecular Properties

Compound Name4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione
PubChem CID160528195
Molecular FormulaC123H75F15N10O10
Molecular Weight2137.98 g/mol
Exact Mass2136.54
IUPAC Name4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione
SMILESCN1C(=O)c2cccc(-n3c4cccc(C(F)(F)F)c4c4c(C(F)(F)F)cccc43)c2C1=O.CN1C(=O)c2cccc(-n3c4ccccc4c4c(C(F)(F)F)cccc43)c2C1=O.Cc1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1cccc2c1C(=O)N(C)C2=O.Cc1cccc2c3cccc(C(F)(F)F)c3n(-c3cccc4c3C(=O)N(c3ccccc3)C4=O)c12.Cc1cccc2c3ccccc3n(-c3cccc4c3C(=O)N(c3ccccc3)C4=O)c12
InChIInChI=1S/C28H17F3N2O2.C27H18N2O2.C23H12F6N2O2.C23H15F3N2O2.C22H13F3N2O2/c1-16-8-5-11-18-19-12-6-14-21(28(29,30)31)25(19)33(24(16)18)22-15-7-13-20-23(22)27(35)32(26(20)34)17-9-3-2-4-10-17;1-17-9-7-13-20-19-12-5-6-15-22(19)29(25(17)20)23-16-8-14-21-24(23)27(31)28(26(21)30)18-10-3-2-4-11-18;1-30-20(32)11-5-2-8-14(17(11)21(30)33)31-15-9-3-6-12(22(24,25)26)18(15)19-13(23(27,28)29)7-4-10-16(19)31;1-12-6-8-17-15(10-12)16-11-13(23(24,25)26)7-9-18(16)28(17)19-5-3-4-14-20(19)22(30)27(2)21(14)29;1-26-20(28)13-7-4-10-17(19(13)21(26)29)27-15-9-3-2-6-12(15)18-14(22(23,24)25)8-5-11-16(18)27/h2-15H,1H3;2-16H,1H3;2-10H,1H3;3-11H,1-2H3;2-11H,1H3
InChIKeyQVEMLUOCJMKYOH-UHFFFAOYSA-N
XLogP29.22
TPSA211.55 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds7
Heavy Atoms158
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002137.98
LogP ≤ 529.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione with MolForge

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Related Compounds

4-[4,5-bis[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-phenylisoindole-1,3-dione
CID 134239969
4-[1,8-bis[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-phenylisoindole-1,3-dione
CID 134239904
2-(2-phenylphenyl)-4-[1-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione
CID 134233924
2-methyl-4-[3-[3-methyl-5-(trifluoromethyl)phenyl]carbazol-9-yl]isoindole-1,3-dione
CID 157300764
4-carbazol-9-yl-2-phenylisoindole-1,3-dione
CID 118972355
4-[2-[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-(4-phenylphenyl)isoindole-1,3-dione
CID 134234839
4-[2-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(3-phenylphenyl)isoindole-1,3-dione
CID 157418592
4-[4-[2,4-bis(trifluoromethyl)phenyl]-5-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2,4-diphenylphenyl)isoindole-1,3-dione;4-[1-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2,4,6-triphenylphenyl)isoindole-1,3-dione;2-(2,4-diphenylphenyl)-4-[4-[2-methyl-4-(trifluoromethyl)phenyl]carbazol-9-yl]isoindole-1,3-dione;2-(2,4-diphenylphenyl)-4-[3-[2-methyl-4-(trifluoromethyl)phenyl]-6-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]isoindole-1,3-dione
CID 159475320
2-(2,6-diphenylphenyl)-4-(1-methylcarbazol-9-yl)isoindole-1,3-dione
CID 134234109
4-[1,8-bis[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-(3-phenylphenyl)isoindole-1,3-dione
CID 134234427
4-carbazol-9-yl-2-[2-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-carbazol-9-yl-2-[3-(4-carbazol-9-yl-1,3-dioxoisoindol-2-yl)phenyl]isoindole-1,3-dione;4-(3,6-ditert-butylcarbazol-9-yl)-2-[2-[4-(3,6-ditert-butylcarbazol-9-yl)-1,3-dioxoisoindol-2-yl]propan-2-yl]isoindole-1,3-dione
CID 159151046
4-[3,6-bis(trifluoromethyl)carbazol-9-yl]-2-(2,4,6-triphenylphenyl)isoindole-1,3-dione
CID 134233982

Frequently Asked Questions

What is the IUPAC name of 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione?
The IUPAC name of 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione (CID 160528195) is 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione.
What is the SMILES notation for 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione?
The canonical SMILES for 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione is CN1C(=O)c2cccc(-n3c4cccc(C(F)(F)F)c4c4c(C(F)(F)F)cccc43)c2C1=O.CN1C(=O)c2cccc(-n3c4ccccc4c4c(C(F)(F)F)cccc43)c2C1=O.Cc1ccc2c(c1)c1cc(C(F)(F)F)ccc1n2-c1cccc2c1C(=O)N(C)C2=O.Cc1cccc2c3cccc(C(F)(F)F)c3n(-c3cccc4c3C(=O)N(c3ccccc3)C4=O)c12.Cc1cccc2c3ccccc3n(-c3cccc4c3C(=O)N(c3ccccc3)C4=O)c12.
What is the InChIKey of 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione?
The InChIKey is QVEMLUOCJMKYOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H17F3N2O2.C27H18N2O2.C23H12F6N2O2.C23H15F3N2O2.C22H13F3N2O2/c1-16-8-5-11-18-19-12-6-14-21(28(29,30)31)25(19)33(24(16)18)22-15-7-13-20-23(22)27(35)32(26(20)34)17-9-3-2-4-10-17;1-17-9-7-13-20-19-12-5-6-15-22(19)29(25(17)20)23-16-8-14-21-24(23)27(31)28(26(21)30)18-10-3-2-4-11-18;1-30-20(32)11-5-2-8-14(17(11)21(30)33)31-15-9-3-6-12(22(24,25)26)18(15)19-13(23(27,28)29)7-4-10-16(19)31;1-12-6-8-17-15(10-12)16-11-13(23(24,25)26)7-9-18(16)28(17)19-5-3-4-14-20(19)22(30)27(2)21(14)29;1-26-20(28)13-7-4-10-17(19(13)21(26)29)27-15-9-3-2-6-12(15)18-14(22(23,24)25)8-5-11-16(18)27/h2-15H,1H3;2-16H,1H3;2-10H,1H3;3-11H,1-2H3;2-11H,1H3.
What are the key properties of 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione?
4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione has a molecular weight of 2137.98 g/mol, XLogP of 29.22, 7 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4,5-bis(trifluoromethyl)carbazol-9-yl]-2-methylisoindole-1,3-dione;4-(1-methylcarbazol-9-yl)-2-phenylisoindole-1,3-dione;2-methyl-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;2-methyl-4-[4-(trifluoromethyl)carbazol-9-yl]isoindole-1,3-dione;4-[1-methyl-8-(trifluoromethyl)carbazol-9-yl]-2-phenylisoindole-1,3-dione is sourced from PubChem (CID 160528195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).