10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole

C164H106N12 — CID 159801398

IUPAC10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccc6c(c5)c5c7ccccc7ccc5n6-c5ccccc5)c4)nc4c3c3ccccc3n4-c3ccccc3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5cccc6c5c5ccccc5n6-c5cccc(-c6ccccc6)c5)c4)nc4c3c3ccccc3n4-c3ccccc3)c2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4ccccc4)c3)nc3c2c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C58H38N4.C56H36N4.C50H32N4/c1-4-18-39(19-5-1)41-22-14-25-44(36-41)56-55-50-31-11-13-34-52(50)62(46-27-8-3-9-28-46)58(55)60-57(59-56)45-26-15-24-43(37-45)48-32-17-35-53-54(48)49-30-10-12-33-51(49)61(53)47-29-16-23-42(38-47)40-20-6-2-7-21-40;1-4-16-37(17-5-1)39-19-14-21-42(34-39)54-53-47-28-12-13-29-49(47)60(45-25-8-3-9-26-45)56(53)58-55(57-54)43-22-15-20-40(35-43)41-31-32-50-48(36-41)52-46-27-11-10-18-38(46)30-33-51(52)59(50)44-23-6-2-7-24-44;1-4-16-34(17-5-1)48-47-41-25-12-13-26-43(41)54(39-22-8-3-9-23-39)50(47)52-49(51-48)37-19-14-18-35(31-37)36-28-29-44-42(32-36)46-40-24-11-10-15-33(40)27-30-45(46)53(44)38-20-6-2-7-21-38/h1-38H;1-36H;1-32H
InChIKeyNJVMDMMSISDWNV-UHFFFAOYSA-N
MW2244.74 g/mol
LogP42.32
Rot. Bonds18

About 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole

10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole (PubChem CID 159801398) has the molecular formula C164H106N12 and a molecular weight of 2244.74 g/mol. Its IUPAC name is 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole.

Molecular Properties

Compound Name10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole
PubChem CID159801398
Molecular FormulaC164H106N12
Molecular Weight2244.74 g/mol
Exact Mass2242.87
IUPAC Name10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccc6c(c5)c5c7ccccc7ccc5n6-c5ccccc5)c4)nc4c3c3ccccc3n4-c3ccccc3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5cccc6c5c5ccccc5n6-c5cccc(-c6ccccc6)c5)c4)nc4c3c3ccccc3n4-c3ccccc3)c2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4ccccc4)c3)nc3c2c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C58H38N4.C56H36N4.C50H32N4/c1-4-18-39(19-5-1)41-22-14-25-44(36-41)56-55-50-31-11-13-34-52(50)62(46-27-8-3-9-28-46)58(55)60-57(59-56)45-26-15-24-43(37-45)48-32-17-35-53-54(48)49-30-10-12-33-51(49)61(53)47-29-16-23-42(38-47)40-20-6-2-7-21-40;1-4-16-37(17-5-1)39-19-14-21-42(34-39)54-53-47-28-12-13-29-49(47)60(45-25-8-3-9-26-45)56(53)58-55(57-54)43-22-15-20-40(35-43)41-31-32-50-48(36-41)52-46-27-11-10-18-38(46)30-33-51(52)59(50)44-23-6-2-7-24-44;1-4-16-34(17-5-1)48-47-41-25-12-13-26-43(41)54(39-22-8-3-9-23-39)50(47)52-49(51-48)37-19-14-18-35(31-37)36-28-29-44-42(32-36)46-40-24-11-10-15-33(40)27-30-45(46)53(44)38-20-6-2-7-21-38/h1-38H;1-36H;1-32H
InChIKeyNJVMDMMSISDWNV-UHFFFAOYSA-N
XLogP42.32
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds18
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002244.74
LogP ≤ 542.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole with MolForge

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Related Compounds

2-[3-(6,9-diphenylcarbazol-4-yl)phenyl]-4,9-diphenylpyrimido[4,5-b]indole;4,9-diphenyl-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;4,9-diphenyl-2-[3-[6-phenyl-9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole
CID 158253323
11-phenyl-8-(2,4,9-triphenylpyrimido[4,5-b]indol-6-yl)benzo[a]carbazole;7-phenyl-10-(2,4,9-triphenylpyrimido[4,5-b]indol-6-yl)benzo[c]carbazole;2,4,9-triphenyl-6-(9-phenylcarbazol-4-yl)pyrimido[4,5-b]indole
CID 158505849
9-phenyl-2-(9-phenylcarbazol-3-yl)-4-(3-phenylphenyl)pyrimido[4,5-b]indole
CID 118232378
2-[3-(3-carbazol-9-ylphenyl)phenyl]-4,9-diphenylpyrimido[4,5-b]indole
CID 154010743
2-(3-carbazol-9-ylphenyl)-9-phenyl-4-(9-phenylcarbazol-3-yl)pyrimido[4,5-b]indole;2-carbazol-9-yl-9-phenyl-4-[9-(3-phenylphenyl)carbazol-3-yl]pyrimido[4,5-b]indole;2-carbazol-9-yl-9-phenyl-4-[9-(4-phenylphenyl)carbazol-3-yl]pyrimido[4,5-b]indole
CID 159842963
2-naphthalen-2-yl-4,9-diphenylpyrimido[4,5-b]indole;2-(3-naphthalen-2-ylphenyl)-4,9-diphenylpyrimido[4,5-b]indole;9-phenyl-2,4-bis(2-phenylphenyl)pyrimido[4,5-b]indole;9-phenyl-2-(2-phenylphenyl)-4-(3-phenylphenyl)pyrimido[4,5-b]indole
CID 158756135
7-[3-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]phenyl]benzo[c]carbazole
CID 166915910
5-[3-[4,6-bis[3-(3,5-diphenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]-3,9-diphenylcarbazole
CID 129265295
4-(3-carbazol-9-ylphenyl)-9-phenyl-2-(9-phenylcarbazol-2-yl)pyrimido[4,5-b]indole
CID 118232381
7-phenyl-10-[7-(3-phenylphenyl)benzo[c]carbazol-10-yl]benzo[c]carbazole
CID 129290171
2-[4-[4-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-4-(3-phenylphenyl)benzo[h]quinazoline
CID 121402041
3-[4-[5,9-bis(3-phenylphenyl)carbazol-3-yl]phenyl]-5,9-bis(3-phenylphenyl)carbazole;5-(3-phenylphenyl)-9-(4-phenylphenyl)-3-[4-[9-phenyl-5-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 158407520

Frequently Asked Questions

What is the IUPAC name of 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole?
The IUPAC name of 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole (CID 159801398) is 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole.
What is the SMILES notation for 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole?
The canonical SMILES for 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole is c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccc6c(c5)c5c7ccccc7ccc5n6-c5ccccc5)c4)nc4c3c3ccccc3n4-c3ccccc3)c2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5cccc6c5c5ccccc5n6-c5cccc(-c6ccccc6)c5)c4)nc4c3c3ccccc3n4-c3ccccc3)c2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4ccccc4)c3)nc3c2c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole?
The InChIKey is NJVMDMMSISDWNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38N4.C56H36N4.C50H32N4/c1-4-18-39(19-5-1)41-22-14-25-44(36-41)56-55-50-31-11-13-34-52(50)62(46-27-8-3-9-28-46)58(55)60-57(59-56)45-26-15-24-43(37-45)48-32-17-35-53-54(48)49-30-10-12-33-51(49)61(53)47-29-16-23-42(38-47)40-20-6-2-7-21-40;1-4-16-37(17-5-1)39-19-14-21-42(34-39)54-53-47-28-12-13-29-49(47)60(45-25-8-3-9-26-45)56(53)58-55(57-54)43-22-15-20-40(35-43)41-31-32-50-48(36-41)52-46-27-11-10-18-38(46)30-33-51(52)59(50)44-23-6-2-7-24-44;1-4-16-34(17-5-1)48-47-41-25-12-13-26-43(41)54(39-22-8-3-9-23-39)50(47)52-49(51-48)37-19-14-18-35(31-37)36-28-29-44-42(32-36)46-40-24-11-10-15-33(40)27-30-45(46)53(44)38-20-6-2-7-21-38/h1-38H;1-36H;1-32H.
What are the key properties of 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole?
10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole has a molecular weight of 2244.74 g/mol, XLogP of 42.32, 18 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(4,9-diphenylpyrimido[4,5-b]indol-2-yl)phenyl]-7-phenylbenzo[c]carbazole;9-phenyl-4-(3-phenylphenyl)-2-[3-[9-(3-phenylphenyl)carbazol-4-yl]phenyl]pyrimido[4,5-b]indole;7-phenyl-10-[3-[9-phenyl-4-(3-phenylphenyl)pyrimido[4,5-b]indol-2-yl]phenyl]benzo[c]carbazole is sourced from PubChem (CID 159801398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).