2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline

C263H157N17O4S4 — CID 157056801

IUPAC2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline
SMILESc1ccc(-c2cc(-c3cccc4c3oc3ccccc34)c3ccc4c(-c5ccc6oc7ccccc7c6c5)nc(-c5ccccc5)nc4c3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3ccc4c(-c5ccc6oc7ccccc7c6c5)nc(-c5ccccc5)nc4c3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3ccc4c(-c5ccccc5)nc(-c5ccc6oc7ccccc7c6c5)nc4c3n2)cc1.c1ccc(-c2nc(-c3cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)c3)cc(-c3ccc4ccc5cccnc5c4n3)n2)cc1.c1ccc(-c2nc(-c3cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)c3)cc(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)n2)cc1
InChIInChI=1S/C70H42N4S2.C64H38N4S2.C47H27N3O2.2C41H25N3O/c1-2-14-45(15-3-1)70-73-62(51-21-10-20-50(38-51)61-34-33-44-32-31-43-22-13-35-71-66(43)67(44)72-61)42-63(74-70)54-40-52(46-16-8-18-48(36-46)55-25-11-27-59-57-23-4-6-29-64(57)75-68(55)59)39-53(41-54)47-17-9-19-49(37-47)56-26-12-28-60-58-24-5-7-30-65(58)76-69(56)60;1-2-13-41(14-3-1)64-67-56(38-57(68-64)55-31-30-40-29-28-39-19-12-32-65-60(39)61(40)66-55)48-36-46(42-15-8-17-44(33-42)49-22-10-24-53-51-20-4-6-26-58(51)69-62(49)53)35-47(37-48)43-16-9-18-45(34-43)50-23-11-25-54-52-21-5-7-27-59(52)70-63(50)54;1-3-12-28(13-4-1)39-27-37(35-19-11-18-34-31-16-7-10-21-41(31)52-46(34)35)33-23-24-36-43(30-22-25-42-38(26-30)32-17-8-9-20-40(32)51-42)49-47(29-14-5-2-6-15-29)50-45(36)44(33)48-39;1-4-12-26(13-5-1)33-25-35(27-14-6-2-7-15-27)42-39-31(33)21-22-32-38(43-41(44-40(32)39)28-16-8-3-9-17-28)29-20-23-37-34(24-29)30-18-10-11-19-36(30)45-37;1-4-12-26(13-5-1)33-25-35(27-14-6-2-7-15-27)42-39-31(33)21-22-32-38(28-16-8-3-9-17-28)43-41(44-40(32)39)29-20-23-37-34(24-29)30-18-10-11-19-36(30)45-37/h1-42H;1-38H;1-27H;2*1-25H
InChIKeyAAVVQHBQIWQOFB-UHFFFAOYSA-N
MW3747.53 g/mol
LogP71.76
Rot. Bonds27

About 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline

2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline (PubChem CID 157056801) has the molecular formula C263H157N17O4S4 and a molecular weight of 3747.53 g/mol. Its IUPAC name is 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline.

Molecular Properties

Compound Name2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline
PubChem CID157056801
Molecular FormulaC263H157N17O4S4
Molecular Weight3747.53 g/mol
Exact Mass3744.15
IUPAC Name2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline
SMILESc1ccc(-c2cc(-c3cccc4c3oc3ccccc34)c3ccc4c(-c5ccc6oc7ccccc7c6c5)nc(-c5ccccc5)nc4c3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3ccc4c(-c5ccc6oc7ccccc7c6c5)nc(-c5ccccc5)nc4c3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3ccc4c(-c5ccccc5)nc(-c5ccc6oc7ccccc7c6c5)nc4c3n2)cc1.c1ccc(-c2nc(-c3cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)c3)cc(-c3ccc4ccc5cccnc5c4n3)n2)cc1.c1ccc(-c2nc(-c3cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)c3)cc(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)n2)cc1
InChIInChI=1S/C70H42N4S2.C64H38N4S2.C47H27N3O2.2C41H25N3O/c1-2-14-45(15-3-1)70-73-62(51-21-10-20-50(38-51)61-34-33-44-32-31-43-22-13-35-71-66(43)67(44)72-61)42-63(74-70)54-40-52(46-16-8-18-48(36-46)55-25-11-27-59-57-23-4-6-29-64(57)75-68(55)59)39-53(41-54)47-17-9-19-49(37-47)56-26-12-28-60-58-24-5-7-30-65(58)76-69(56)60;1-2-13-41(14-3-1)64-67-56(38-57(68-64)55-31-30-40-29-28-39-19-12-32-65-60(39)61(40)66-55)48-36-46(42-15-8-17-44(33-42)49-22-10-24-53-51-20-4-6-26-58(51)69-62(49)53)35-47(37-48)43-16-9-18-45(34-43)50-23-11-25-54-52-21-5-7-27-59(52)70-63(50)54;1-3-12-28(13-4-1)39-27-37(35-19-11-18-34-31-16-7-10-21-41(31)52-46(34)35)33-23-24-36-43(30-22-25-42-38(26-30)32-17-8-9-20-40(32)51-42)49-47(29-14-5-2-6-15-29)50-45(36)44(33)48-39;1-4-12-26(13-5-1)33-25-35(27-14-6-2-7-15-27)42-39-31(33)21-22-32-38(43-41(44-40(32)39)28-16-8-3-9-17-28)29-20-23-37-34(24-29)30-18-10-11-19-36(30)45-37;1-4-12-26(13-5-1)33-25-35(27-14-6-2-7-15-27)42-39-31(33)21-22-32-38(28-16-8-3-9-17-28)43-41(44-40(32)39)29-20-23-37-34(24-29)30-18-10-11-19-36(30)45-37/h1-42H;1-38H;1-27H;2*1-25H
InChIKeyAAVVQHBQIWQOFB-UHFFFAOYSA-N
XLogP71.76
TPSA271.69 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds27
Heavy Atoms288
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003747.53
LogP ≤ 571.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline with MolForge

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Related Compounds

18-(4-Dibenzofuran-2-yl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)-22-fluoro-5-isoquinolin-5-yl-9-thia-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3(8),4,6,11,13,15,19(24),20,22-undecaene
CID 134276447
2-[6-[4-(4-Tert-butylphenyl)-6-[8-[6-[4-[6-[2-(3-fluorophenyl)-3-pyridinyl]dibenzothiophen-4-yl]-6-phenyl-1,3,5-triazin-2-yl]-4-phenyldibenzofuran-2-yl]-6-phenyldibenzothiophen-4-yl]-1,3,5-triazin-2-yl]dibenzofuran-4-yl]quinazoline
CID 148308671
N,N-bis[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-phenylbenzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N,N-bis[3-[2-(2,6-dimethylphenyl)thieno[3,2-c]pyridin-4-yl]-5-phenylbenzene-2-id-1-yl]-2,4-dimethylpyridin-3-amine;N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-methylbenzene-2-id-1-yl]-N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-3-phenyl-N-(2-phenylphenyl)-5-[2-(4-phenylphenyl)furo[3,2-c]pyridin-4-yl]benzene-6-id-1-amine;tetrakis(platinum(2+))
CID 157550492
CID 157743742
CID 157743742
4-(1,7-Difluoro-2,3-dimethyldibenzofuran-4-yl)-3-methyl-7-(3,3,3-trifluoro-2,2-dimethylpropyl)quinazolin-3-ium;4-(7-fluoro-2,3-dimethyldibenzofuran-4-yl)-3,6-dimethyl-7-propan-2-ylthieno[3,2-d]pyrimidin-3-ium;4-(7-fluoro-2,3-dimethyldibenzofuran-4-yl)-3-methyl-7-propan-2-ylthieno[3,2-d]pyrimidin-3-ium;4-(7-fluoro-3-methyldibenzofuran-4-yl)-3,6-dimethyl-7-propan-2-ylthieno[3,2-d]pyrimidin-3-ium;4-(7-fluoro-3-methyldibenzofuran-4-yl)-3-methyl-7-propan-2-ylthieno[3,2-d]pyrimidin-3-ium
CID 159051207
2-[9-(4,6-Diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-4-(4-fluorophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-4-(2-isocyanophenyl)-[1]benzothiolo[3,2-d]pyrimidine;2-[3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-4-[4-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-d]pyrimidine
CID 159169158
6-Dibenzothiophen-2-yl-3-isocyano-1,9-diphenylcarbazole;3,9-di(dibenzofuran-2-yl)-6-isocyanocarbazole;3-isocyano-6-(1-phenylbenzimidazol-4-yl)-9-[5-[6-(trifluoromethyl)dibenzothiophen-2-yl]-3-pyridinyl]carbazole
CID 160492128
15-dibenzofuran-2-yl-20-methyl-10-oxa-18-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene;15-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-10-oxa-17,20-diazapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;4-(19-methyl-10-oxa-18-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaen-15-yl)-N,N-diphenylaniline;12-phenyl-17-oxa-9-azahexacyclo[12.11.0.02,11.03,8.016,24.018,23]pentacosa-1,3,5,7,9,11,13,15,18,20,22,24-dodecaene;12-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-17-oxa-10-azahexacyclo[12.11.0.02,11.04,9.016,24.018,23]pentacosa-1(25),2,4,6,8,10,12,14,16(24),18,20,22-dodecaene
CID 161212579
CID 161814794
CID 161814794
12-Dibenzothiophen-4-yl-23-thia-10-azahexacyclo[12.11.0.02,11.03,8.016,24.017,22]pentacosa-1(25),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene;20-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-18-methyl-10-oxa-15-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;17-methyl-20-(9-phenylcarbazol-3-yl)-10-thia-15,18-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;15-methyl-20-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-10-thia-18-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 161901264
4-[3-[8-[3-[4,6-Bis(4-phenylpyrimidin-2-yl)-8-(2-pyridin-2-yl-3-pyridinyl)dibenzofuran-2-yl]phenyl]-4b,9b-dihydro-[1]benzothiolo[3,2-b][1]benzothiol-3-yl]phenyl]-8-[2-methyl-3-(2-methyl-3-pyrazin-2-ylphenyl)phenyl]-12-(2-pyrazin-2-yl-3-pyridinyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene
CID 57958245
9-[8-[4,6-Di(propan-2-yl)-8-[3-pyridin-2-yl-6-(3-pyrimidin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-4,6-di(propan-2-yl)dibenzothiophen-2-yl]-3-pyridin-2-yl-6-(3-pyrimidin-2-ylphenyl)carbazole
CID 57958351

Frequently Asked Questions

What is the IUPAC name of 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline?
The IUPAC name of 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline (CID 157056801) is 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline.
What is the SMILES notation for 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline?
The canonical SMILES for 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline is c1ccc(-c2cc(-c3cccc4c3oc3ccccc34)c3ccc4c(-c5ccc6oc7ccccc7c6c5)nc(-c5ccccc5)nc4c3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3ccc4c(-c5ccc6oc7ccccc7c6c5)nc(-c5ccccc5)nc4c3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3ccc4c(-c5ccccc5)nc(-c5ccc6oc7ccccc7c6c5)nc4c3n2)cc1.c1ccc(-c2nc(-c3cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)c3)cc(-c3ccc4ccc5cccnc5c4n3)n2)cc1.c1ccc(-c2nc(-c3cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)cc(-c4cccc(-c5cccc6c5sc5ccccc56)c4)c3)cc(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)n2)cc1.
What is the InChIKey of 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline?
The InChIKey is AAVVQHBQIWQOFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H42N4S2.C64H38N4S2.C47H27N3O2.2C41H25N3O/c1-2-14-45(15-3-1)70-73-62(51-21-10-20-50(38-51)61-34-33-44-32-31-43-22-13-35-71-66(43)67(44)72-61)42-63(74-70)54-40-52(46-16-8-18-48(36-46)55-25-11-27-59-57-23-4-6-29-64(57)75-68(55)59)39-53(41-54)47-17-9-19-49(37-47)56-26-12-28-60-58-24-5-7-30-65(58)76-69(56)60;1-2-13-41(14-3-1)64-67-56(38-57(68-64)55-31-30-40-29-28-39-19-12-32-65-60(39)61(40)66-55)48-36-46(42-15-8-17-44(33-42)49-22-10-24-53-51-20-4-6-26-58(51)69-62(49)53)35-47(37-48)43-16-9-18-45(34-43)50-23-11-25-54-52-21-5-7-27-59(52)70-63(50)54;1-3-12-28(13-4-1)39-27-37(35-19-11-18-34-31-16-7-10-21-41(31)52-46(34)35)33-23-24-36-43(30-22-25-42-38(26-30)32-17-8-9-20-40(32)51-42)49-47(29-14-5-2-6-15-29)50-45(36)44(33)48-39;1-4-12-26(13-5-1)33-25-35(27-14-6-2-7-15-27)42-39-31(33)21-22-32-38(43-41(44-40(32)39)28-16-8-3-9-17-28)29-20-23-37-34(24-29)30-18-10-11-19-36(30)45-37;1-4-12-26(13-5-1)33-25-35(27-14-6-2-7-15-27)42-39-31(33)21-22-32-38(28-16-8-3-9-17-28)43-41(44-40(32)39)29-20-23-37-34(24-29)30-18-10-11-19-36(30)45-37/h1-42H;1-38H;1-27H;2*1-25H.
What are the key properties of 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline?
2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline has a molecular weight of 3747.53 g/mol, XLogP of 71.76, 27 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]-1,10-phenanthroline;2-[3-[6-[3,5-bis(3-dibenzothiophen-4-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-1,10-phenanthroline;4-dibenzofuran-2-yl-7-dibenzofuran-4-yl-2,9-diphenylpyrido[3,2-h]quinazoline;2-dibenzofuran-2-yl-4,7,9-triphenylpyrido[3,2-h]quinazoline;4-dibenzofuran-2-yl-2,7,9-triphenylpyrido[3,2-h]quinazoline is sourced from PubChem (CID 157056801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).