4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole

C155H96N12O3 — CID 157204197

IUPAC4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)nc(-c4cccc5c4C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)n3)cc2)nc1.c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1
InChIInChI=1S/2C52H32N4O.C51H32N4O/c1-2-15-33(16-3-1)49-53-50(34-17-14-18-36(31-34)56-45-25-10-5-20-39(45)40-21-6-11-26-46(40)56)55-51(54-49)35-29-30-38-37-19-4-7-22-41(37)52(44(38)32-35)42-23-8-12-27-47(42)57-48-28-13-9-24-43(48)52;1-2-14-33(15-3-1)49-53-50(34-26-29-36(30-27-34)56-45-22-10-5-17-39(45)40-18-6-11-23-46(40)56)55-51(54-49)35-28-31-38-37-16-4-7-19-41(37)52(44(38)32-35)42-20-8-12-24-47(42)57-48-25-13-9-21-43(48)52;1-2-15-40-37(12-1)38-13-11-14-39(49(38)51(40)41-16-3-5-20-47(41)56-48-21-6-4-17-42(48)51)50-54-45(35-26-22-33(23-27-35)43-18-7-9-30-52-43)32-46(55-50)36-28-24-34(25-29-36)44-19-8-10-31-53-44/h2*1-32H;1-32H
InChIKeyARDPJROUINRJAH-UHFFFAOYSA-N
MW2174.55 g/mol
LogP36.95
Rot. Bonds13

About 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole

4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole (PubChem CID 157204197) has the molecular formula C155H96N12O3 and a molecular weight of 2174.55 g/mol. Its IUPAC name is 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
PubChem CID157204197
Molecular FormulaC155H96N12O3
Molecular Weight2174.55 g/mol
Exact Mass2172.77
IUPAC Name4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)nc(-c4cccc5c4C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)n3)cc2)nc1.c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1
InChIInChI=1S/2C52H32N4O.C51H32N4O/c1-2-15-33(16-3-1)49-53-50(34-17-14-18-36(31-34)56-45-25-10-5-20-39(45)40-21-6-11-26-46(40)56)55-51(54-49)35-29-30-38-37-19-4-7-22-41(37)52(44(38)32-35)42-23-8-12-27-47(42)57-48-28-13-9-24-43(48)52;1-2-14-33(15-3-1)49-53-50(34-26-29-36(30-27-34)56-45-22-10-5-17-39(45)40-18-6-11-23-46(40)56)55-51(54-49)35-28-31-38-37-16-4-7-19-41(37)52(44(38)32-35)42-20-8-12-24-47(42)57-48-25-13-9-21-43(48)52;1-2-15-40-37(12-1)38-13-11-14-39(49(38)51(40)41-16-3-5-20-47(41)56-48-21-6-4-17-42(48)51)50-54-45(35-26-22-33(23-27-35)43-18-7-9-30-52-43)32-46(55-50)36-28-24-34(25-29-36)44-19-8-10-31-53-44/h2*1-32H;1-32H
InChIKeyARDPJROUINRJAH-UHFFFAOYSA-N
XLogP36.95
TPSA166.45 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds13
Heavy Atoms170
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002174.55
LogP ≤ 536.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[4-[4-[2-[4-Amino-6-(3-ethynylisoquinolin-7-yl)-5-[3-fluoro-4-(4-methylpyrimidin-2-yl)oxyphenyl]pyrrolo[2,3-d]pyrimidin-7-yl]ethyl]pyrimidin-2-yl]oxy-3-fluorophenyl]-6-(2-ethynylquinolin-6-yl)-7-methylpyrrolo[2,3-d]pyrimidin-4-amine
CID 155310034
25-(4-Fluorophenyl)-4'-[3-[2-[4'-[7-(2-spiro[4-oxa-25-azahexacyclo[12.11.0.03,12.05,10.015,24.016,21]pentacosa-1,3(12),5,7,9,13,15(24),16,18,20,22-undecaene-11,9'-fluorene]-25-ylquinazolin-4-yl)naphthalen-2-yl]spiro[4-oxa-25-azahexacyclo[12.11.0.03,12.05,10.015,24.016,21]pentacosa-1,3(12),5,7,9,13,15(24),16,18,20,22-undecaene-11,9'-fluorene]-25-yl]quinolin-4-yl]phenyl]spiro[4-oxa-25-azahexacyclo[12.11.0.03,12.05,10.015,24.016,21]pentacosa-1,3(12),5,7,9,13,15(24),16,18,20,22-undecaene-11,9'-fluorene]
CID 156227618
6-methyl-2-[3-[(4-methyl-2-pyridinyl)oxy]-5-(trifluoromethyl)benzene-2-id-1-yl]-9-(5-methylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-methylpyrimidin-2-yl)-3-(trifluoromethyl)-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]-5-(trifluoromethyl)benzene-2-id-1-yl]-9-(5-methylpyrimidin-2-yl)-1H-carbazol-1-ide;tris(platinum(2+))
CID 157071401
4-[4,6-Bis[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-9-spiro[fluorene-9,9'-xanthene]-2-ylcarbazole;9-(2,7-ditert-butylspiro[fluorene-9,9'-xanthene]-4-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-spiro[fluorene-9,9'-xanthene]-4-ylcarbazole;4-[4-[4-phenyl-6-[3-(3-spiro[fluorene-9,9'-xanthene]-4-ylcarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 157266218
2-[3-[(3-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(4-tert-butyl-2-pyridinyl)oxy]-5-methylbenzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(4-tert-butyl-2-pyridinyl)oxy]-5-(trifluoromethyl)benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-6-methyl-1H-carbazol-1-ide;2-[3-[(4-tert-butyl-2-pyridinyl)oxy]-5-(trifluoromethyl)benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))
CID 157966291
9-(4-methylphenyl)-9-phenyl-N,N-bis(4-phenylphenyl)-7-pyridin-3-ylfluoren-4-amine;9-(4-methylphenyl)-9-phenyl-N,N-bis(4-phenylphenyl)-7-pyrimidin-5-ylfluoren-4-amine;9-methyl-9-phenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine;9-naphthalen-1-yl-9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)fluoren-3-amine;9-phenyl-N,N-bis(4-phenylphenyl)-9-[3-(2-phenylpyrimidin-4-yl)phenyl]fluoren-4-amine;9-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)-9-[4-(trifluoromethoxy)phenyl]fluoren-3-amine
CID 158384592
9-(4-tert-butyl-2-pyridinyl)-2-[3-isoquinolin-1-yloxy-5-(trifluoromethyl)benzene-2-id-1-yl]-6-methyl-3-(trifluoromethyl)-1H-carbazol-1-ide;2-[3-[(4-tert-butyl-2-pyridinyl)oxy]-5-(trifluoromethyl)benzene-2-id-1-yl]-9-isoquinolin-3-yl-6-methyl-1H-carbazol-1-ide;9-isoquinolin-3-yl-2-[3-isoquinolin-1-yloxy-5-(trifluoromethyl)benzene-2-id-1-yl]-6-methyl-1H-carbazol-1-ide;pentakis(platinum(2+));9-pyrazin-2-yl-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-pyrimidin-2-yl-1H-carbazol-1-ide
CID 158516879
2'-[3,5-Bis[4-(trifluoromethoxy)phenyl]phenyl]spiro[fluorene-9,9'-xanthene];2-(4-dibenzothiophen-3-ylphenyl)-4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine;2-phenyl-4-(4-pyridin-2-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine;7-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazin-2-yl)phenyl]benzo[c]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 159358717
2'-[3,5-Bis[4-(trifluoromethoxy)phenyl]phenyl]spiro[fluorene-9,9'-xanthene];2-(4-fluoranthen-8-ylphenyl)-4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine;2-phenyl-4-(4-pyridin-2-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine;5-phenyl-2-spiro[fluorene-9,9'-xanthene]-2'-ylquinoxaline;9-[4-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole;2-spiro[fluorene-9,9'-xanthene]-2'-ylquinoxaline
CID 159450050
2-[4-[3,5-Bis[4-(trifluoromethoxy)phenyl]phenyl]phenyl]-4,5,6-trimethylpyrimidine;12,12-dimethyl-11-[3-(4,5,6-trimethylpyrimidin-2-yl)phenyl]indeno[2,1-a]carbazole;2-[4-[2-(4-isocyanophenyl)naphthalen-1-yl]phenyl]-4,5,6-trimethylpyrimidine;4-[4-[7-(4-isocyanophenyl)spiro[fluorene-9,9'-xanthene]-2-yl]phenyl]-2,5,6-trimethylpyrimidine
CID 159640647
3'-[3,5-Bis[4-(trifluoromethoxy)phenyl]phenyl]spiro[fluorene-9,9'-xanthene];2-(4-dibenzothiophen-3-ylphenyl)-4-phenyl-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazine;2-phenyl-4-(4-pyridin-2-ylphenyl)-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazine;7-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-3'-yl-1,3,5-triazin-2-yl)phenyl]benzo[c]carbazole
CID 160042667
4-[4,6-Bis[4-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]-9-spiro[fluorene-9,9'-xanthene]-2-ylcarbazole;9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-spiro[fluorene-9,9'-xanthene]-4-ylcarbazole;methane;4-[4-[2-phenyl-6-[3-(3-spiro[fluorene-9,9'-xanthene]-4-ylcarbazol-9-yl)phenyl]pyrimidin-4-yl]phenyl]benzonitrile
CID 161194184

Frequently Asked Questions

What is the IUPAC name of 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
The IUPAC name of 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole (CID 157204197) is 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole.
What is the SMILES notation for 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
The canonical SMILES for 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole is c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)nc(-c4cccc5c4C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)n3)cc2)nc1.c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1.
What is the InChIKey of 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
The InChIKey is ARDPJROUINRJAH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H32N4O.C51H32N4O/c1-2-15-33(16-3-1)49-53-50(34-17-14-18-36(31-34)56-45-25-10-5-20-39(45)40-21-6-11-26-46(40)56)55-51(54-49)35-29-30-38-37-19-4-7-22-41(37)52(44(38)32-35)42-23-8-12-27-47(42)57-48-28-13-9-24-43(48)52;1-2-14-33(15-3-1)49-53-50(34-26-29-36(30-27-34)56-45-22-10-5-17-39(45)40-18-6-11-23-46(40)56)55-51(54-49)35-28-31-38-37-16-4-7-19-41(37)52(44(38)32-35)42-20-8-12-24-47(42)57-48-25-13-9-21-43(48)52;1-2-15-40-37(12-1)38-13-11-14-39(49(38)51(40)41-16-3-5-20-47(41)56-48-21-6-4-17-42(48)51)50-54-45(35-26-22-33(23-27-35)43-18-7-9-30-52-43)32-46(55-50)36-28-24-34(25-29-36)44-19-8-10-31-53-44/h2*1-32H;1-32H.
What are the key properties of 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole?
4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole has a molecular weight of 2174.55 g/mol, XLogP of 36.95, 13 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(4-pyridin-2-ylphenyl)-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidine;9-[3-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole is sourced from PubChem (CID 157204197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).