1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine

C310H191Cl5N6O6S5 — CID 167586873

IUPAC1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine
SMILESCC1(C)c2cc(-c3ccc(N(c4cc(-c5cccc6ccccc56)c5oc6ccccc6c5c4)c4cccc5c4-c4ccccc4C54c5ccccc5Sc5ccc(Cl)cc54)cc3)ccc2-c2ccc3ccccc3c21.Clc1ccc(-c2ccc3c(c2)C2(c4ccccc4Sc4ccc(N(c5ccc6ccccc6c5)c5cc(-c6ccc(-c7ccccc7)cc6)c6oc7ccccc7c6c5)cc42)c2ccccc2-3)cc1.Clc1ccc2c(c1)C1(c3ccccc3S2)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)cc3)cc21.Clc1ccc2c(c1)c1cc(-c3ccc4c(c3)-c3cc(N(c5ccccc5)c5cc(-c6ccccc6)c6oc7ccccc7c6c5)ccc3C43c4ccccc4Sc4ccccc43)ccc1n2-c1ccccc1.Clc1cccc2c1-c1ccccc1C21c2ccccc2Sc2ccc(N(c3ccccc3)c3cc(-c4ccc5occc5c4)c4c(c3)oc3ccccc34)cc21
InChIInChI=1S/C72H46ClNOS.C67H41ClN2OS.C65H40ClNOS.C55H34ClNOS.C51H30ClNO2S/c1-71(2)62-39-46(32-36-53(62)55-37-31-45-16-4-6-19-51(45)69(55)71)43-29-34-48(35-30-43)74(49-41-57(52-22-13-17-44-15-3-5-18-50(44)52)70-58(42-49)54-20-8-11-27-65(54)75-70)64-26-14-25-61-68(64)56-21-7-9-23-59(56)72(61)60-24-10-12-28-66(60)76-67-38-33-47(73)40-63(67)72;68-45-30-35-62-55(38-45)54-37-44(29-34-61(54)70(62)47-20-8-3-9-21-47)43-28-32-57-52(36-43)53-39-48(31-33-58(53)67(57)59-23-11-14-26-64(59)72-65-27-15-12-24-60(65)67)69(46-18-6-2-7-19-46)49-40-51(42-16-4-1-5-17-42)66-56(41-49)50-22-10-13-25-63(50)71-66;66-48-30-26-44(27-31-48)47-29-34-53-52-16-6-8-18-57(52)65(59(53)37-47)58-19-9-11-21-62(58)69-63-35-33-50(40-60(63)65)67(49-32-28-42-14-4-5-15-46(42)36-49)51-38-55(64-56(39-51)54-17-7-10-20-61(54)68-64)45-24-22-43(23-25-45)41-12-2-1-3-13-41;56-38-26-32-52-48(34-38)55(46-20-10-12-22-51(46)59-52)45-19-9-7-17-42(45)43-29-25-37(33-47(43)55)35-23-27-40(28-24-35)57(39-15-5-2-6-16-39)49-31-30-41(36-13-3-1-4-14-36)54-53(49)44-18-8-11-21-50(44)58-54;52-43-18-10-17-41-50(43)36-13-4-6-15-39(36)51(41)40-16-7-9-20-47(40)56-48-24-22-34(29-42(48)51)53(33-11-2-1-3-12-33)35-28-38(31-21-23-44-32(27-31)25-26-54-44)49-37-14-5-8-19-45(37)55-46(49)30-35/h3-42H,1-2H3;1-41H;1-40H;1-34H;1-30H
InChIKeyHXKYJGRXHPENTE-UHFFFAOYSA-N
MW4433.57 g/mol
LogP88.96
Rot. Bonds26

About 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine

1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine (PubChem CID 167586873) has the molecular formula C310H191Cl5N6O6S5 and a molecular weight of 4433.57 g/mol. Its IUPAC name is 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine.

Molecular Properties

Compound Name1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine
PubChem CID167586873
Molecular FormulaC310H191Cl5N6O6S5
Molecular Weight4433.57 g/mol
Exact Mass4427.19
IUPAC Name1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine
SMILESCC1(C)c2cc(-c3ccc(N(c4cc(-c5cccc6ccccc56)c5oc6ccccc6c5c4)c4cccc5c4-c4ccccc4C54c5ccccc5Sc5ccc(Cl)cc54)cc3)ccc2-c2ccc3ccccc3c21.Clc1ccc(-c2ccc3c(c2)C2(c4ccccc4Sc4ccc(N(c5ccc6ccccc6c5)c5cc(-c6ccc(-c7ccccc7)cc6)c6oc7ccccc7c6c5)cc42)c2ccccc2-3)cc1.Clc1ccc2c(c1)C1(c3ccccc3S2)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)cc3)cc21.Clc1ccc2c(c1)c1cc(-c3ccc4c(c3)-c3cc(N(c5ccccc5)c5cc(-c6ccccc6)c6oc7ccccc7c6c5)ccc3C43c4ccccc4Sc4ccccc43)ccc1n2-c1ccccc1.Clc1cccc2c1-c1ccccc1C21c2ccccc2Sc2ccc(N(c3ccccc3)c3cc(-c4ccc5occc5c4)c4c(c3)oc3ccccc34)cc21
InChIInChI=1S/C72H46ClNOS.C67H41ClN2OS.C65H40ClNOS.C55H34ClNOS.C51H30ClNO2S/c1-71(2)62-39-46(32-36-53(62)55-37-31-45-16-4-6-19-51(45)69(55)71)43-29-34-48(35-30-43)74(49-41-57(52-22-13-17-44-15-3-5-18-50(44)52)70-58(42-49)54-20-8-11-27-65(54)75-70)64-26-14-25-61-68(64)56-21-7-9-23-59(56)72(61)60-24-10-12-28-66(60)76-67-38-33-47(73)40-63(67)72;68-45-30-35-62-55(38-45)54-37-44(29-34-61(54)70(62)47-20-8-3-9-21-47)43-28-32-57-52(36-43)53-39-48(31-33-58(53)67(57)59-23-11-14-26-64(59)72-65-27-15-12-24-60(65)67)69(46-18-6-2-7-19-46)49-40-51(42-16-4-1-5-17-42)66-56(41-49)50-22-10-13-25-63(50)71-66;66-48-30-26-44(27-31-48)47-29-34-53-52-16-6-8-18-57(52)65(59(53)37-47)58-19-9-11-21-62(58)69-63-35-33-50(40-60(63)65)67(49-32-28-42-14-4-5-15-46(42)36-49)51-38-55(64-56(39-51)54-17-7-10-20-61(54)68-64)45-24-22-43(23-25-45)41-12-2-1-3-13-41;56-38-26-32-52-48(34-38)55(46-20-10-12-22-51(46)59-52)45-19-9-7-17-42(45)43-29-25-37(33-47(43)55)35-23-27-40(28-24-35)57(39-15-5-2-6-16-39)49-31-30-41(36-13-3-1-4-14-36)54-53(49)44-18-8-11-21-50(44)58-54;52-43-18-10-17-41-50(43)36-13-4-6-15-39(36)51(41)40-16-7-9-20-47(40)56-48-24-22-34(29-42(48)51)53(33-11-2-1-3-12-33)35-28-38(31-21-23-44-32(27-31)25-26-54-44)49-37-14-5-8-19-45(37)55-46(49)30-35/h3-42H,1-2H3;1-41H;1-40H;1-34H;1-30H
InChIKeyHXKYJGRXHPENTE-UHFFFAOYSA-N
XLogP88.96
TPSA99.97 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds26
Heavy Atoms332
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004433.57
LogP ≤ 588.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine with MolForge

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Related Compounds

6'-chloro-4-N-dibenzothiophen-2-yl-3-N'-(4-naphthalen-2-yldibenzofuran-2-yl)-4-N-(1-phenyldibenzofuran-3-yl)-3-N'-(4-phenylphenyl)spiro[fluorene-9,9'-thioxanthene]-3',4-diamine;6'-chloro-4-N-dibenzothiophen-2-yl-3-N'-phenyl-4-N-(1-phenyldibenzofuran-3-yl)-3-N'-(1-phenyldibenzothiophen-3-yl)spiro[fluorene-9,9'-thioxanthene]-3',4-diamine;N-[5'-chloro-3-[4-(N-(1-phenyldibenzothiophen-2-yl)anilino)phenyl]spiro[fluorene-9,9'-thioxanthene]-3'-yl]-N,4-diphenyldibenzofuran-2-amine;3-(4-chlorophenyl)-3-N',5-N'-diphenyl-5-N'-(3-phenyldibenzofuran-1-yl)-3-N'-(4-phenyldibenzofuran-2-yl)spiro[fluorene-9,9'-thioxanthene]-3',5'-diamine
CID 159141093
2'-(3-chloronaphthalen-2-yl)spiro[fluorene-9,9'-thioxanthene];3'-(3-chlorophenyl)spiro[fluorene-9,9'-xanthene];6-chloro-3-N',4-N,6-N'-triphenyl-4-N-(4-phenyldibenzofuran-2-yl)-3-N',6-N'-bis(3-phenyldibenzothiophen-1-yl)spiro[fluorene-9,9'-thioxanthene]-3',4,6'-triamine;3',6'-dichloro-3-N,6-N-bis(4-naphthalen-2-yldibenzothiophen-2-yl)-3-N,6-N-diphenylspiro[fluorene-9,9'-thioxanthene]-3,6-diamine;3',6'-dichloro-3-N-(4-dibenzofuran-4-yldibenzothiophen-2-yl)-3-N,5-N-diphenyl-5-N-(4-phenyldibenzofuran-2-yl)spiro[fluorene-9,9'-thioxanthene]-3,5-diamine;3,6-dichloro-3-N',6-N'-diphenyl-3-N',6-N'-bis(1-phenyldibenzofuran-3-yl)spiro[fluorene-9,9'-thioxanthene]-3',6'-diamine
CID 165026507
N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 163577680
N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-(9,9-dimethylfluoren-1-yl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-4-amine;N-(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-N-(4-phenylphenyl)benzo[g]fluoren-9-amine;N-[3-(9,9-dimethylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-(9,9-dimethylfluoren-1-yl)-N-(3-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;2-[9-naphthalen-2-yl-6-[2-(N-phenylanilino)phenyl]carbazol-3-yl]-N,N-diphenylaniline;N-(4-phenylphenyl)-9-[2-(4-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 165042249
5'-chloro-N-(1,1-dimethylinden-5-yl)-N-[4-(4-phenylphenyl)dibenzothiophen-2-yl]spiro[fluorene-9,9'-thioxanthene]-2'-amine;6'-chloro-N-phenyl-N-(1-phenyldibenzothiophen-2-yl)spiro[fluorene-9,9'-thioxanthene]-3'-amine;N-(6'-chlorospiro[fluorene-9,9'-thioxanthene]-3'-yl)-N-dibenzothiophen-2-yl-1-phenyldibenzofuran-3-amine;N-(7'-chlorospiro[fluorene-9,9'-thioxanthene]-3'-yl)-N-[3-(9,9-dimethylfluoren-1-yl)phenyl]-4-pyridin-3-yldibenzofuran-2-amine;N-[2-(7'-chlorospiro[fluorene-9,9'-thioxanthene]-4'-yl)naphthalen-1-yl]-N,4-diphenyldibenzofuran-1-amine;N-(6'-chlorospiro[fluorene-9,9'-thioxanthene]-3'-yl)-4-naphthalen-2-yl-N-phenyldibenzofuran-2-amine
CID 167710956
N-(9,9-dimethylfluoren-4-yl)-N-[4-[8-[9,9-dimethyl-7-[N-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-4-(4-phenylphenyl)anilino]fluoren-3-yl]dibenzofuran-4-yl]phenyl]-8-(9-phenylcarbazol-3-yl)dibenzofuran-1-amine
CID 167095022
1-N-dibenzofuran-2-yl-3-N-(9,9-dimethylfluoren-2-yl)-1-N,3-N-diphenyl-5-(9-phenylcarbazol-3-yl)benzene-1,3-diamine;3-N-dibenzofuran-4-yl-1-N-(9,9-dimethylfluoren-2-yl)-1-N,3-N-diphenyl-5-(9-phenylcarbazol-3-yl)benzene-1,3-diamine;3-N-naphthalen-1-yl-1-N-naphthalen-2-yl-1-N,3-N-diphenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 159339591
N-(4-dibenzofuran-4-ylphenyl)-N-phenylspiro[benzo[a]thioxanthene-12,9'-fluorene]-3'-amine;N-(2,4-diphenylphenyl)-N-(4-phenylphenyl)spiro[benzo[a]thioxanthene-12,9'-fluorene]-3'-amine;N-(2-phenylphenyl)-N-(4-phenylphenyl)spiro[benzo[a]thioxanthene-12,9'-fluorene]-3'-amine
CID 162132227
4-(3-carbazol-9-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(2-naphthalen-1-ylphenyl)dibenzofuran-2-amine
CID 176607739
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-1-amine;N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-3-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-spiro[9-oxapentacyclo[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-ylphenyl)fluoren-2-amine;3-phenyl-N,N-bis(4-phenylphenyl)-9,9'-spirobi[fluorene]-3'-amine;N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-3-yl)dibenzofuran-2-amine
CID 161039068
N-dibenzofuran-4-yl-9-[17'-[9',9'-dimethyl-6'-(N-(4-phenylphenyl)anilino)spiro[fluorene-9,14'-pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene]-2-yl]-9',9'-dimethylspiro[fluorene-9,14'-pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene]-6'-yl]-N-(4-phenylphenyl)carbazol-3-amine
CID 167117957
7-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaen-11-yl)-9,9-dimethyl-N,N-diphenylfluoren-2-amine;4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaen-11-yl)-N,N-diphenylnaphthalen-1-amine;N-[3-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaen-11-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)naphthalen-1-amine;N-[4-[4-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1,3,5,7,10,12,14,16,18-nonaen-11-yl)phenyl]phenyl]-N-phenylnaphtho[2,1-b][1]benzofuran-9-amine
CID 158781362

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine?
The IUPAC name of 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine (CID 167586873) is 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine.
What is the SMILES notation for 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine?
The canonical SMILES for 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine is CC1(C)c2cc(-c3ccc(N(c4cc(-c5cccc6ccccc56)c5oc6ccccc6c5c4)c4cccc5c4-c4ccccc4C54c5ccccc5Sc5ccc(Cl)cc54)cc3)ccc2-c2ccc3ccccc3c21.Clc1ccc(-c2ccc3c(c2)C2(c4ccccc4Sc4ccc(N(c5ccc6ccccc6c5)c5cc(-c6ccc(-c7ccccc7)cc6)c6oc7ccccc7c6c5)cc42)c2ccccc2-3)cc1.Clc1ccc2c(c1)C1(c3ccccc3S2)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)cc3)cc21.Clc1ccc2c(c1)c1cc(-c3ccc4c(c3)-c3cc(N(c5ccccc5)c5cc(-c6ccccc6)c6oc7ccccc7c6c5)ccc3C43c4ccccc4Sc4ccccc43)ccc1n2-c1ccccc1.Clc1cccc2c1-c1ccccc1C21c2ccccc2Sc2ccc(N(c3ccccc3)c3cc(-c4ccc5occc5c4)c4c(c3)oc3ccccc34)cc21.
What is the InChIKey of 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine?
The InChIKey is HXKYJGRXHPENTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H46ClNOS.C67H41ClN2OS.C65H40ClNOS.C55H34ClNOS.C51H30ClNO2S/c1-71(2)62-39-46(32-36-53(62)55-37-31-45-16-4-6-19-51(45)69(55)71)43-29-34-48(35-30-43)74(49-41-57(52-22-13-17-44-15-3-5-18-50(44)52)70-58(42-49)54-20-8-11-27-65(54)75-70)64-26-14-25-61-68(64)56-21-7-9-23-59(56)72(61)60-24-10-12-28-66(60)76-67-38-33-47(73)40-63(67)72;68-45-30-35-62-55(38-45)54-37-44(29-34-61(54)70(62)47-20-8-3-9-21-47)43-28-32-57-52(36-43)53-39-48(31-33-58(53)67(57)59-23-11-14-26-64(59)72-65-27-15-12-24-60(65)67)69(46-18-6-2-7-19-46)49-40-51(42-16-4-1-5-17-42)66-56(41-49)50-22-10-13-25-63(50)71-66;66-48-30-26-44(27-31-48)47-29-34-53-52-16-6-8-18-57(52)65(59(53)37-47)58-19-9-11-21-62(58)69-63-35-33-50(40-60(63)65)67(49-32-28-42-14-4-5-15-46(42)36-49)51-38-55(64-56(39-51)54-17-7-10-20-61(54)68-64)45-24-22-43(23-25-45)41-12-2-1-3-13-41;56-38-26-32-52-48(34-38)55(46-20-10-12-22-51(46)59-52)45-19-9-7-17-42(45)43-29-25-37(33-47(43)55)35-23-27-40(28-24-35)57(39-15-5-2-6-16-39)49-31-30-41(36-13-3-1-4-14-36)54-53(49)44-18-8-11-21-50(44)58-54;52-43-18-10-17-41-50(43)36-13-4-6-15-39(36)51(41)40-16-7-9-20-47(40)56-48-24-22-34(29-42(48)51)53(33-11-2-1-3-12-33)35-28-38(31-21-23-44-32(27-31)25-26-54-44)49-37-14-5-8-19-45(37)55-46(49)30-35/h3-42H,1-2H3;1-41H;1-40H;1-34H;1-30H.
What are the key properties of 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine?
1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine has a molecular weight of 4433.57 g/mol, XLogP of 88.96, 26 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-5-yl)-N-(4-chlorospiro[fluorene-9,9'-thioxanthene]-2'-yl)-N-phenyldibenzofuran-3-amine;N-[6-(6-chloro-9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-thioxanthene]-3-yl]-N,4-diphenyldibenzofuran-2-amine;N-[2-(4-chlorophenyl)spiro[fluorene-9,9'-thioxanthene]-2'-yl]-N-naphthalen-2-yl-4-(4-phenylphenyl)dibenzofuran-2-amine;N-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-4-yl)-N-[4-(11,11-dimethylbenzo[a]fluoren-9-yl)phenyl]-4-naphthalen-1-yldibenzofuran-2-amine;N-[4-(2'-chlorospiro[fluorene-9,9'-thioxanthene]-2-yl)phenyl]-N,4-diphenyldibenzofuran-1-amine is sourced from PubChem (CID 167586873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).