2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile

C357H210N28 — CID 162067244

IUPAC2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile
SMILESN#Cc1cc2c(c3ccccc13)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)cc21.N#Cc1cc2c(c3ccccc13)-c1ccccc1C21c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21.N#Cc1ccc(-c2cc3c(c4ccccc24)-c2ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)cc2C32c3ccccc3-c3ccccc32)cc1.N#Cc1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)c4ccccc4c2-3)cc1.N#Cc1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4ccccc4c2-3)cc1.N#Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)c3ccccc3c1-2.N#Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c3ccccc3c1-2
InChIInChI=1S/2C57H34N4.3C51H30N4.2C45H26N4/c58-35-36-23-25-38(26-24-36)48-34-52-53(46-20-8-7-17-43(46)48)47-32-31-42(33-51(47)57(52)49-21-11-9-18-44(49)45-19-10-12-22-50(45)57)37-27-29-41(30-28-37)56-60-54(39-13-3-1-4-14-39)59-55(61-56)40-15-5-2-6-16-40;58-35-36-23-25-37(26-24-36)42-31-32-47-51(33-42)57(49-21-11-9-18-44(49)45-19-10-12-22-50(45)57)52-34-48(43-17-7-8-20-46(43)53(47)52)38-27-29-41(30-28-38)56-60-54(39-13-3-1-4-14-39)59-55(61-56)40-15-5-2-6-16-40;52-31-32-23-28-41-45(29-32)51(43-21-11-9-18-38(43)39-19-10-12-22-44(39)51)46-30-42(37-17-7-8-20-40(37)47(41)46)33-24-26-36(27-25-33)50-54-48(34-13-3-1-4-14-34)53-49(55-50)35-15-5-2-6-16-35;52-31-32-23-25-33(26-24-32)36-27-28-41-45(29-36)51(43-21-11-9-18-38(43)39-19-10-12-22-44(39)51)46-30-42(37-17-7-8-20-40(37)47(41)46)50-54-48(34-13-3-1-4-14-34)53-49(55-50)35-15-5-2-6-16-35;52-31-37-30-46-47(41-19-8-7-17-38(37)41)42-20-10-12-22-44(42)51(46)43-21-11-9-18-39(43)40-28-27-36(29-45(40)51)32-23-25-35(26-24-32)50-54-48(33-13-3-1-4-14-33)53-49(55-50)34-15-5-2-6-16-34;46-27-28-23-24-35-39(25-28)45(37-21-11-9-18-32(37)33-19-10-12-22-38(33)45)40-26-36(31-17-7-8-20-34(31)41(35)40)44-48-42(29-13-3-1-4-14-29)47-43(49-44)30-15-5-2-6-16-30;46-27-31-26-40-41(35-19-8-7-17-32(31)35)36-20-10-12-22-38(36)45(40)37-21-11-9-18-33(37)34-24-23-30(25-39(34)45)44-48-42(28-13-3-1-4-14-28)47-43(49-44)29-15-5-2-6-16-29/h2*1-34H;3*1-30H;2*1-26H
InChIKeyZAPRFTKKEHPRAI-UHFFFAOYSA-N
MW4891.80 g/mol
LogP83.36
Rot. Bonds28

About 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile

2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile (PubChem CID 162067244) has the molecular formula C357H210N28 and a molecular weight of 4891.80 g/mol. Its IUPAC name is 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile.

Molecular Properties

Compound Name2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile
PubChem CID162067244
Molecular FormulaC357H210N28
Molecular Weight4891.80 g/mol
Exact Mass4887.73
IUPAC Name2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile
SMILESN#Cc1cc2c(c3ccccc13)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)cc21.N#Cc1cc2c(c3ccccc13)-c1ccccc1C21c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21.N#Cc1ccc(-c2cc3c(c4ccccc24)-c2ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)cc2C32c3ccccc3-c3ccccc32)cc1.N#Cc1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)c4ccccc4c2-3)cc1.N#Cc1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4ccccc4c2-3)cc1.N#Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)c3ccccc3c1-2.N#Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c3ccccc3c1-2
InChIInChI=1S/2C57H34N4.3C51H30N4.2C45H26N4/c58-35-36-23-25-38(26-24-36)48-34-52-53(46-20-8-7-17-43(46)48)47-32-31-42(33-51(47)57(52)49-21-11-9-18-44(49)45-19-10-12-22-50(45)57)37-27-29-41(30-28-37)56-60-54(39-13-3-1-4-14-39)59-55(61-56)40-15-5-2-6-16-40;58-35-36-23-25-37(26-24-36)42-31-32-47-51(33-42)57(49-21-11-9-18-44(49)45-19-10-12-22-50(45)57)52-34-48(43-17-7-8-20-46(43)53(47)52)38-27-29-41(30-28-38)56-60-54(39-13-3-1-4-14-39)59-55(61-56)40-15-5-2-6-16-40;52-31-32-23-28-41-45(29-32)51(43-21-11-9-18-38(43)39-19-10-12-22-44(39)51)46-30-42(37-17-7-8-20-40(37)47(41)46)33-24-26-36(27-25-33)50-54-48(34-13-3-1-4-14-34)53-49(55-50)35-15-5-2-6-16-35;52-31-32-23-25-33(26-24-32)36-27-28-41-45(29-36)51(43-21-11-9-18-38(43)39-19-10-12-22-44(39)51)46-30-42(37-17-7-8-20-40(37)47(41)46)50-54-48(34-13-3-1-4-14-34)53-49(55-50)35-15-5-2-6-16-35;52-31-37-30-46-47(41-19-8-7-17-38(37)41)42-20-10-12-22-44(42)51(46)43-21-11-9-18-39(43)40-28-27-36(29-45(40)51)32-23-25-35(26-24-32)50-54-48(33-13-3-1-4-14-33)53-49(55-50)34-15-5-2-6-16-34;46-27-28-23-24-35-39(25-28)45(37-21-11-9-18-32(37)33-19-10-12-22-38(33)45)40-26-36(31-17-7-8-20-34(31)41(35)40)44-48-42(29-13-3-1-4-14-29)47-43(49-44)30-15-5-2-6-16-30;46-27-31-26-40-41(35-19-8-7-17-32(31)35)36-20-10-12-22-38(36)45(40)37-21-11-9-18-33(37)34-24-23-30(25-39(34)45)44-48-42(28-13-3-1-4-14-28)47-43(49-44)29-15-5-2-6-16-29/h2*1-34H;3*1-30H;2*1-26H
InChIKeyZAPRFTKKEHPRAI-UHFFFAOYSA-N
XLogP83.36
TPSA437.22 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds28
Heavy Atoms385
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004891.80
LogP ≤ 583.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile with MolForge

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Related Compounds

4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-diphenylbenzo[g]fluoren-9-yl]benzonitrile
CID 159211457
7'-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-carbonitrile
CID 162776381
4-[5-(4-cyanophenyl)-4'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-thioxanthene]-9-yl]benzonitrile;2-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[b]fluorene-11,9'-thioxanthene]-4',8-dicarbonitrile;8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[b]fluorene-11,9'-thioxanthene]-2,4'-dicarbonitrile
CID 159237178
4-[4-phenyl-6-[3-[4-(3'-phenyl-9,9'-spirobi[fluorene]-2'-yl)phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile;4-[4-phenyl-6-[4-[4-(3'-phenyl-9,9'-spirobi[fluorene]-2'-yl)phenyl]phenyl]-1,3,5-triazin-2-yl]benzonitrile;4-[4-phenyl-6-[4-(3'-phenyl-9,9'-spirobi[fluorene]-2'-yl)phenyl]-1,3,5-triazin-2-yl]benzonitrile
CID 160984017
4-[4'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-xanthene]-5-yl]benzonitrile
CID 157175356
4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-xanthene]-4'-yl]benzonitrile
CID 161128839
4-[2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[9-thiapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene-14,9'-fluorene]-11-yl]benzonitrile
CID 147588893
4-[7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,9'-thioxanthene]-2-yl]naphthalene-1-carbonitrile;4-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-thioxanthene]-2-yl]naphthalene-1-carbonitrile;4-[4-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-thioxanthene]-2-yl]naphthalen-1-yl]benzonitrile;7-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]spiro[fluorene-9,9'-thioxanthene]-2-carbonitrile
CID 158608993
7'-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9,9'-spirobi[fluorene]-4'-carbonitrile
CID 166796512
7'-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-9,9'-spirobi[fluorene]-2'-carbonitrile
CID 162775697
4-[7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylbenzo[c]fluoren-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-thioxanthene]-4'-carbonitrile;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-xanthene]-5-yl]benzonitrile
CID 160585364
4-[5'-[4-[4-[3-[4-[4-[4-[5'-(4-cyanophenyl)spiro[fluorene-9,9'-xanthene]-4'-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4'-yl]benzonitrile
CID 146362550

Frequently Asked Questions

What is the IUPAC name of 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile?
The IUPAC name of 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile (CID 162067244) is 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile.
What is the SMILES notation for 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile?
The canonical SMILES for 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile is N#Cc1cc2c(c3ccccc13)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)cc21.N#Cc1cc2c(c3ccccc13)-c1ccccc1C21c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21.N#Cc1ccc(-c2cc3c(c4ccccc24)-c2ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)cc2C32c3ccccc3-c3ccccc32)cc1.N#Cc1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)c4ccccc4c2-3)cc1.N#Cc1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4ccccc4c2-3)cc1.N#Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)c3ccccc3c1-2.N#Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c3ccccc3c1-2.
What is the InChIKey of 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile?
The InChIKey is ZAPRFTKKEHPRAI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C57H34N4.3C51H30N4.2C45H26N4/c58-35-36-23-25-38(26-24-36)48-34-52-53(46-20-8-7-17-43(46)48)47-32-31-42(33-51(47)57(52)49-21-11-9-18-44(49)45-19-10-12-22-50(45)57)37-27-29-41(30-28-37)56-60-54(39-13-3-1-4-14-39)59-55(61-56)40-15-5-2-6-16-40;58-35-36-23-25-37(26-24-36)42-31-32-47-51(33-42)57(49-21-11-9-18-44(49)45-19-10-12-22-50(45)57)52-34-48(43-17-7-8-20-46(43)53(47)52)38-27-29-41(30-28-38)56-60-54(39-13-3-1-4-14-39)59-55(61-56)40-15-5-2-6-16-40;52-31-32-23-28-41-45(29-32)51(43-21-11-9-18-38(43)39-19-10-12-22-44(39)51)46-30-42(37-17-7-8-20-40(37)47(41)46)33-24-26-36(27-25-33)50-54-48(34-13-3-1-4-14-34)53-49(55-50)35-15-5-2-6-16-35;52-31-32-23-25-33(26-24-32)36-27-28-41-45(29-36)51(43-21-11-9-18-38(43)39-19-10-12-22-44(39)51)46-30-42(37-17-7-8-20-40(37)47(41)46)50-54-48(34-13-3-1-4-14-34)53-49(55-50)35-15-5-2-6-16-35;52-31-37-30-46-47(41-19-8-7-17-38(37)41)42-20-10-12-22-44(42)51(46)43-21-11-9-18-39(43)40-28-27-36(29-45(40)51)32-23-25-35(26-24-32)50-54-48(33-13-3-1-4-14-33)53-49(55-50)34-15-5-2-6-16-34;46-27-28-23-24-35-39(25-28)45(37-21-11-9-18-32(37)33-19-10-12-22-38(33)45)40-26-36(31-17-7-8-20-34(31)41(35)40)44-48-42(29-13-3-1-4-14-29)47-43(49-44)30-15-5-2-6-16-30;46-27-31-26-40-41(35-19-8-7-17-32(31)35)36-20-10-12-22-38(36)45(40)37-21-11-9-18-33(37)34-24-23-30(25-39(34)45)44-48-42(28-13-3-1-4-14-28)47-43(49-44)29-15-5-2-6-16-29/h2*1-34H;3*1-30H;2*1-26H.
What are the key properties of 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile?
2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile has a molecular weight of 4891.80 g/mol, XLogP of 83.36, 28 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;4-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-yl]benzonitrile;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile;2'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[c]fluorene-7,9'-fluorene]-5-carbonitrile;5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-carbonitrile;4-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-yl]benzonitrile is sourced from PubChem (CID 162067244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).