4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione

C178H111F15N10O8 — CID 158725657

IUPAC4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione
SMILESCc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c(C(F)(F)F)c1.Cc1ccc(-c2ccc3c4ccccc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c(C)c1.Cc1ccc(-c2cccc3c4cccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)c4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c23)c(C)c1.O=C1c2cccc(-n3c4cccc(-c5ccccn5)c4c4c(-c5ccccn5)cccc43)c2C(=O)N1c1ccccc1-c1ccccc1
InChIInChI=1S/C48H27F9N2O2.C48H30F6N2O2.C42H26N4O2.C40H28N2O2/c1-26-14-18-31(37(22-26)47(52,53)54)28-15-19-34-35-20-16-29(32-21-17-30(46(49,50)51)25-38(32)48(55,56)57)24-42(35)58(41(34)23-28)40-13-7-11-36-43(40)45(61)59(44(36)60)39-12-6-5-10-33(39)27-8-3-2-4-9-27;1-27-21-23-31(28(2)25-27)34-14-8-16-36-37-17-9-15-35(33-24-22-30(47(49,50)51)26-39(33)48(52,53)54)44(37)55(43(34)36)41-20-10-18-38-42(41)46(58)56(45(38)57)40-19-7-6-13-32(40)29-11-4-3-5-12-29;47-41-31-18-12-24-37(40(31)42(48)46(41)34-21-5-4-15-28(34)27-13-2-1-3-14-27)45-35-22-10-16-29(32-19-6-8-25-43-32)38(35)39-30(17-11-23-36(39)45)33-20-7-9-26-44-33;1-25-19-21-29(26(2)23-25)28-20-22-32-31-14-7-9-17-35(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/h2-25H,1H3;3-26H,1-2H3;1-26H;3-24H,1-2H3
InChIKeyIKLTVNQCZROPDM-UHFFFAOYSA-N
MW2802.88 g/mol
LogP46.10
Rot. Bonds19

About 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione

4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione (PubChem CID 158725657) has the molecular formula C178H111F15N10O8 and a molecular weight of 2802.88 g/mol. Its IUPAC name is 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione.

Molecular Properties

Compound Name4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione
PubChem CID158725657
Molecular FormulaC178H111F15N10O8
Molecular Weight2802.88 g/mol
Exact Mass2800.83
IUPAC Name4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione
SMILESCc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c(C(F)(F)F)c1.Cc1ccc(-c2ccc3c4ccccc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c(C)c1.Cc1ccc(-c2cccc3c4cccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)c4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c23)c(C)c1.O=C1c2cccc(-n3c4cccc(-c5ccccn5)c4c4c(-c5ccccn5)cccc43)c2C(=O)N1c1ccccc1-c1ccccc1
InChIInChI=1S/C48H27F9N2O2.C48H30F6N2O2.C42H26N4O2.C40H28N2O2/c1-26-14-18-31(37(22-26)47(52,53)54)28-15-19-34-35-20-16-29(32-21-17-30(46(49,50)51)25-38(32)48(55,56)57)24-42(35)58(41(34)23-28)40-13-7-11-36-43(40)45(61)59(44(36)60)39-12-6-5-10-33(39)27-8-3-2-4-9-27;1-27-21-23-31(28(2)25-27)34-14-8-16-36-37-17-9-15-35(33-24-22-30(47(49,50)51)26-39(33)48(52,53)54)44(37)55(43(34)36)41-20-10-18-38-42(41)46(58)56(45(38)57)40-19-7-6-13-32(40)29-11-4-3-5-12-29;47-41-31-18-12-24-37(40(31)42(48)46(41)34-21-5-4-15-28(34)27-13-2-1-3-14-27)45-35-22-10-16-29(32-19-6-8-25-43-32)38(35)39-30(17-11-23-36(39)45)33-20-7-9-26-44-33;1-25-19-21-29(26(2)23-25)28-20-22-32-31-14-7-9-17-35(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/h2-25H,1H3;3-26H,1-2H3;1-26H;3-24H,1-2H3
InChIKeyIKLTVNQCZROPDM-UHFFFAOYSA-N
XLogP46.10
TPSA195.02 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds19
Heavy Atoms211
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002802.88
LogP ≤ 546.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione with MolForge

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Related Compounds

1,10,19,28-Tetrazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-3(40),4,6,8,12(39),13,15,17,21(38),22,24,26,30(37),31,33,35-hexadecaene-2,11,20,29-tetrone
CID 15229602
4-(1-(4-fluorobenzoyl)-1H-indol-4-yl)-7-(4-methylpiperazine-1-carbonyl)-9H-carbazole-1-carboxamide
CID 59375025
5,5'-(Hexafluoro-2,2-propanediyl)bis[2-(9-ethyl-9H-carbazole-3-yl)isoindoline-1,3-dione]
CID 102290993
2-Methyl-5-[2-[4-[2-methyl-4-[5-[2-[4-(4-methyl-2-pyridin-3-ylphenyl)-3-pyridin-3-ylphenyl]-1,3-dioxoisoindol-5-yl]-1,3-dioxoisoindol-2-yl]phenyl]-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]isoindole-1,3-dione
CID 117826198
[1-(5-Fluoropentyl)indol-3-yl]-[4-[[3-(4-methylnaphthalene-1-carbonyl)-1-pentylindol-6-yl]methyl]naphthalen-1-yl]methanone
CID 123575449
2-(9-Ethylcarbazol-3-yl)-5-[2-[2-(9-ethylcarbazol-3-yl)-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]isoindole-1,3-dione
CID 130417548
1-[[7-(difluoromethyl)-1-[1-ethyl-3-(methylcarbamoyl)indol-5-yl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-3-yl]methyl]-5-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-N-methylindole-3-carboxamide
CID 132181495
4-[2,7-Bis(trifluoromethyl)carbazol-9-yl]-2-(2,6-diphenylphenyl)isoindole-1,3-dione
CID 134233945
4-[2-[2,4-Bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-(3,5-diphenylphenyl)isoindole-1,3-dione
CID 134233997
4-[2,7-Bis[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-(3,5-diphenylphenyl)isoindole-1,3-dione
CID 134233999
4-[2-[2,4-Bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2,6-diphenylphenyl)isoindole-1,3-dione
CID 134234005
4-[2,7-Bis[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2,6-diphenylphenyl)isoindole-1,3-dione
CID 134234315

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione?
The IUPAC name of 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione (CID 158725657) is 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione.
What is the SMILES notation for 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione?
The canonical SMILES for 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione is Cc1ccc(-c2ccc3c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c(C(F)(F)F)c1.Cc1ccc(-c2ccc3c4ccccc4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c3c2)c(C)c1.Cc1ccc(-c2cccc3c4cccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)c4n(-c4cccc5c4C(=O)N(c4ccccc4-c4ccccc4)C5=O)c23)c(C)c1.O=C1c2cccc(-n3c4cccc(-c5ccccn5)c4c4c(-c5ccccn5)cccc43)c2C(=O)N1c1ccccc1-c1ccccc1.
What is the InChIKey of 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione?
The InChIKey is IKLTVNQCZROPDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H27F9N2O2.C48H30F6N2O2.C42H26N4O2.C40H28N2O2/c1-26-14-18-31(37(22-26)47(52,53)54)28-15-19-34-35-20-16-29(32-21-17-30(46(49,50)51)25-38(32)48(55,56)57)24-42(35)58(41(34)23-28)40-13-7-11-36-43(40)45(61)59(44(36)60)39-12-6-5-10-33(39)27-8-3-2-4-9-27;1-27-21-23-31(28(2)25-27)34-14-8-16-36-37-17-9-15-35(33-24-22-30(47(49,50)51)26-39(33)48(52,53)54)44(37)55(43(34)36)41-20-10-18-38-42(41)46(58)56(45(38)57)40-19-7-6-13-32(40)29-11-4-3-5-12-29;47-41-31-18-12-24-37(40(31)42(48)46(41)34-21-5-4-15-28(34)27-13-2-1-3-14-27)45-35-22-10-16-29(32-19-6-8-25-43-32)38(35)39-30(17-11-23-36(39)45)33-20-7-9-26-44-33;1-25-19-21-29(26(2)23-25)28-20-22-32-31-14-7-9-17-35(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/h2-25H,1H3;3-26H,1-2H3;1-26H;3-24H,1-2H3.
What are the key properties of 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione?
4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione has a molecular weight of 2802.88 g/mol, XLogP of 46.10, 19 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2,4-bis(trifluoromethyl)phenyl]-8-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-[2,4-bis(trifluoromethyl)phenyl]-7-[4-methyl-2-(trifluoromethyl)phenyl]carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-[2-(2,4-dimethylphenyl)carbazol-9-yl]-2-(2-phenylphenyl)isoindole-1,3-dione;4-(4,5-dipyridin-2-ylcarbazol-9-yl)-2-(2-phenylphenyl)isoindole-1,3-dione is sourced from PubChem (CID 158725657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).