9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole

C157H89F15N20 — CID 158045930

IUPAC9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole
SMILESFc1cc(F)cc(-c2cc(-n3c4ccc(-c5ncccn5)cc4c4cc(-c5ncccn5)ccc43)c(C(F)(F)F)cc2-n2c3ccc(-c4ncccn4)cc3c3cc(-c4ncccn4)ccc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccccc6)n5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4cccc(-c5ccccc5)n4)cc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5ncccn5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4ncccn4)cc32)c1
InChIInChI=1S/C59H35F5N4.C53H29F5N10.C45H25F5N6/c60-41-29-40(30-42(61)33-41)47-34-58(68-54-24-10-8-18-44(54)46-28-26-39(32-56(46)68)52-22-12-20-50(66-52)37-15-5-2-6-16-37)48(59(62,63)64)35-57(47)67-53-23-9-7-17-43(53)45-27-25-38(31-55(45)67)51-21-11-19-49(65-51)36-13-3-1-4-14-36;54-35-21-34(22-36(55)27-35)37-28-48(68-45-11-7-32(51-63-17-3-18-64-51)25-40(45)41-26-33(8-12-46(41)68)52-65-19-4-20-66-52)42(53(56,57)58)29-47(37)67-43-9-5-30(49-59-13-1-14-60-49)23-38(43)39-24-31(6-10-44(39)67)50-61-15-2-16-62-50;46-29-19-28(20-30(47)23-29)35-24-42(56-38-10-4-2-8-32(38)34-14-12-27(22-40(34)56)44-53-17-6-18-54-44)36(45(48,49)50)25-41(35)55-37-9-3-1-7-31(37)33-13-11-26(21-39(33)55)43-51-15-5-16-52-43/h1-35H;1-29H;1-25H
InChIKeyFIXISYALJKFQAB-UHFFFAOYSA-N
MW2540.55 g/mol
LogP40.73
Rot. Bonds19

About 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole

9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole (PubChem CID 158045930) has the molecular formula C157H89F15N20 and a molecular weight of 2540.55 g/mol. Its IUPAC name is 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole.

Molecular Properties

Compound Name9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole
PubChem CID158045930
Molecular FormulaC157H89F15N20
Molecular Weight2540.55 g/mol
Exact Mass2538.73
IUPAC Name9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole
SMILESFc1cc(F)cc(-c2cc(-n3c4ccc(-c5ncccn5)cc4c4cc(-c5ncccn5)ccc43)c(C(F)(F)F)cc2-n2c3ccc(-c4ncccn4)cc3c3cc(-c4ncccn4)ccc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccccc6)n5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4cccc(-c5ccccc5)n4)cc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5ncccn5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4ncccn4)cc32)c1
InChIInChI=1S/C59H35F5N4.C53H29F5N10.C45H25F5N6/c60-41-29-40(30-42(61)33-41)47-34-58(68-54-24-10-8-18-44(54)46-28-26-39(32-56(46)68)52-22-12-20-50(66-52)37-15-5-2-6-16-37)48(59(62,63)64)35-57(47)67-53-23-9-7-17-43(53)45-27-25-38(31-55(45)67)51-21-11-19-49(65-51)36-13-3-1-4-14-36;54-35-21-34(22-36(55)27-35)37-28-48(68-45-11-7-32(51-63-17-3-18-64-51)25-40(45)41-26-33(8-12-46(41)68)52-65-19-4-20-66-52)42(53(56,57)58)29-47(37)67-43-9-5-30(49-59-13-1-14-60-49)23-38(43)39-24-31(6-10-44(39)67)50-61-15-2-16-62-50;46-29-19-28(20-30(47)23-29)35-24-42(56-38-10-4-2-8-32(38)34-14-12-27(22-40(34)56)44-53-17-6-18-54-44)36(45(48,49)50)25-41(35)55-37-9-3-1-7-31(37)33-13-11-26(21-39(33)55)43-51-15-5-16-52-43/h1-35H;1-29H;1-25H
InChIKeyFIXISYALJKFQAB-UHFFFAOYSA-N
XLogP40.73
TPSA210.04 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds19
Heavy Atoms192
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002540.55
LogP ≤ 540.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole with MolForge

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Related Compounds

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CID 139184536
9-[3-Fluoro-5-[6-[6-(4-pyrido[2,3-b]indol-9-ylphenyl)-2-pyridinyl]-2-pyridinyl]phenyl]pyrido[2,3-b]indole
CID 58099056
5-[4-(2,6-Diphenylpyrimidin-4-yl)-2,3,5,6-tetrafluorophenyl]pyrido[4,3-b]indole
CID 58750635
9-[4-[3-[6-Phenyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]phenyl]phenyl]-3,6-dipyridin-2-ylcarbazole
CID 67949352
2-(2-Adamantyl)-9-[3-[2-(2-adamantyl)-6-ethylpyrimido[4,5-b]indol-9-yl]-5-(trifluoromethyl)phenyl]-6-ethylpyrimido[4,5-b]indole
CID 67988504
9-[4-[3-[4-(3-Fluorophenyl)phenyl]phenyl]pyrimidin-2-yl]-3-(9-phenyl-4a,9a-dihydrocarbazol-3-yl)carbazole
CID 68015399
3-[9-[5-[3-Fluoro-5-(4-phenylphenyl)phenyl]pyrimidin-2-yl]-2,3-dihydrocarbazol-3-yl]-9-phenylcarbazole
CID 68015410
3-[9-(4-Fluorophenyl)carbazol-3-yl]-9-[4-[3-(4-phenylphenyl)phenyl]pyrimidin-2-yl]carbazole
CID 68015483
5-Phenyl-7-[4-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]pyridin-2-yl]-3-(trifluoromethyl)indolo[2,3-b]carbazole
CID 68082641
3-(4-Fluorophenyl)-2-[3-[3-(4-fluorophenyl)imidazo[4,5-f][1,10]phenanthrolin-2-yl]phenyl]imidazo[4,5-f][1,10]phenanthroline
CID 74538788
9-Phenyl-3-[2-[1-(9-phenylcarbazol-3-yl)-4-(trifluoromethyl)imidazol-2-yl]-4-(trifluoromethyl)imidazol-1-yl]carbazole
CID 87849614
9,23-Bis[3-methyl-5-(trifluoromethyl)phenyl]-7,9,21,23-tetrazaoctacyclo[13.13.2.02,10.03,8.012,29.016,24.017,22.026,30]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene
CID 89308898

Frequently Asked Questions

What is the IUPAC name of 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole?
The IUPAC name of 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole (CID 158045930) is 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole.
What is the SMILES notation for 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole?
The canonical SMILES for 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole is Fc1cc(F)cc(-c2cc(-n3c4ccc(-c5ncccn5)cc4c4cc(-c5ncccn5)ccc43)c(C(F)(F)F)cc2-n2c3ccc(-c4ncccn4)cc3c3cc(-c4ncccn4)ccc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccccc6)n5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4cccc(-c5ccccc5)n4)cc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5ncccn5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4ncccn4)cc32)c1.
What is the InChIKey of 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole?
The InChIKey is FIXISYALJKFQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H35F5N4.C53H29F5N10.C45H25F5N6/c60-41-29-40(30-42(61)33-41)47-34-58(68-54-24-10-8-18-44(54)46-28-26-39(32-56(46)68)52-22-12-20-50(66-52)37-15-5-2-6-16-37)48(59(62,63)64)35-57(47)67-53-23-9-7-17-43(53)45-27-25-38(31-55(45)67)51-21-11-19-49(65-51)36-13-3-1-4-14-36;54-35-21-34(22-36(55)27-35)37-28-48(68-45-11-7-32(51-63-17-3-18-64-51)25-40(45)41-26-33(8-12-46(41)68)52-65-19-4-20-66-52)42(53(56,57)58)29-47(37)67-43-9-5-30(49-59-13-1-14-60-49)23-38(43)39-24-31(6-10-44(39)67)50-61-15-2-16-62-50;46-29-19-28(20-30(47)23-29)35-24-42(56-38-10-4-2-8-32(38)34-14-12-27(22-40(34)56)44-53-17-6-18-54-44)36(45(48,49)50)25-41(35)55-37-9-3-1-7-31(37)33-13-11-26(21-39(33)55)43-51-15-5-16-52-43/h1-35H;1-29H;1-25H.
What are the key properties of 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole?
9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole has a molecular weight of 2540.55 g/mol, XLogP of 40.73, 19 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(3,5-difluorophenyl)-4-[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-3,6-di(pyrimidin-2-yl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(6-phenyl-2-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-(2-pyrimidin-2-ylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole is sourced from PubChem (CID 158045930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).