7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole

C182H118N30O2 — CID 159230949

IUPAC7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole
SMILESc1ccc(-c2nc(-n3c4ccccc4c4c5ccccc5ccc43)nc3c(-c4ccccc4)nc(-n4c5ccccc5c5c6ccccc6ccc54)nc23)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cnccc43)nc3c(-c4ccccc4)nc(-n4c5ccccc5c5cnccc54)nc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1nc(-n2c3ccccc3c3ccccc32)c2nc(-n3c4ccccc4c4ccccc43)nc(-n3c4ccccc4c4ccccc43)c2n1.c1ccc2c(c1)c1ccccc1n2-c1nc(N2CCOCC2)c2nc(-n3c4ccccc4c4ccccc43)nc(N3CCOCC3)c2n1
InChIInChI=1S/C54H32N8.C50H30N6.C40H24N8.C38H32N8O2/c1-9-25-41-33(17-1)34-18-2-10-26-42(34)59(41)51-49-50(56-53(57-51)61-45-29-13-5-21-37(45)38-22-6-14-30-46(38)61)52(60-43-27-11-3-19-35(43)36-20-4-12-28-44(36)60)58-54(55-49)62-47-31-15-7-23-39(47)40-24-8-16-32-48(40)62;1-3-17-33(18-4-1)45-47-48(54-49(51-45)55-39-25-13-11-23-37(39)43-35-21-9-7-15-31(35)27-29-41(43)55)46(34-19-5-2-6-20-34)52-50(53-47)56-40-26-14-12-24-38(40)44-36-22-10-8-16-32(36)28-30-42(44)56;1-3-11-25(12-4-1)35-37-38(46-39(43-35)47-31-17-9-7-15-27(31)29-23-41-21-19-33(29)47)36(26-13-5-2-6-14-26)44-40(45-37)48-32-18-10-8-16-28(32)30-24-42-22-20-34(30)48;1-5-13-29-25(9-1)26-10-2-6-14-30(26)45(29)37-39-33-34(35(41-37)43-17-21-47-22-18-43)40-38(42-36(33)44-19-23-48-24-20-44)46-31-15-7-3-11-27(31)28-12-4-8-16-32(28)46/h1-32H;1-30H;1-24H;1-16H,17-24H2
InChIKeyKSWTYNLUCJXQHB-UHFFFAOYSA-N
MW2757.15 g/mol
LogP40.09
Rot. Bonds16

About 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole

7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole (PubChem CID 159230949) has the molecular formula C182H118N30O2 and a molecular weight of 2757.15 g/mol. Its IUPAC name is 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole.

Molecular Properties

Compound Name7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole
PubChem CID159230949
Molecular FormulaC182H118N30O2
Molecular Weight2757.15 g/mol
Exact Mass2755.01
IUPAC Name7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole
SMILESc1ccc(-c2nc(-n3c4ccccc4c4c5ccccc5ccc43)nc3c(-c4ccccc4)nc(-n4c5ccccc5c5c6ccccc6ccc54)nc23)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cnccc43)nc3c(-c4ccccc4)nc(-n4c5ccccc5c5cnccc54)nc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1nc(-n2c3ccccc3c3ccccc32)c2nc(-n3c4ccccc4c4ccccc43)nc(-n3c4ccccc4c4ccccc43)c2n1.c1ccc2c(c1)c1ccccc1n2-c1nc(N2CCOCC2)c2nc(-n3c4ccccc4c4ccccc43)nc(N3CCOCC3)c2n1
InChIInChI=1S/C54H32N8.C50H30N6.C40H24N8.C38H32N8O2/c1-9-25-41-33(17-1)34-18-2-10-26-42(34)59(41)51-49-50(56-53(57-51)61-45-29-13-5-21-37(45)38-22-6-14-30-46(38)61)52(60-43-27-11-3-19-35(43)36-20-4-12-28-44(36)60)58-54(55-49)62-47-31-15-7-23-39(47)40-24-8-16-32-48(40)62;1-3-17-33(18-4-1)45-47-48(54-49(51-45)55-39-25-13-11-23-37(39)43-35-21-9-7-15-31(35)27-29-41(43)55)46(34-19-5-2-6-20-34)52-50(53-47)56-40-26-14-12-24-38(40)44-36-22-10-8-16-32(36)28-30-42(44)56;1-3-11-25(12-4-1)35-37-38(46-39(43-35)47-31-17-9-7-15-27(31)29-23-41-21-19-33(29)47)36(26-13-5-2-6-14-26)44-40(45-37)48-32-18-10-8-16-28(32)30-24-42-22-20-34(30)48;1-5-13-29-25(9-1)26-10-2-6-14-30(26)45(29)37-39-33-34(35(41-37)43-17-21-47-22-18-43)40-38(42-36(33)44-19-23-48-24-20-44)46-31-15-7-3-11-27(31)28-12-4-8-16-32(28)46/h1-32H;1-30H;1-24H;1-16H,17-24H2
InChIKeyKSWTYNLUCJXQHB-UHFFFAOYSA-N
XLogP40.09
TPSA306.26 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds16
Heavy Atoms214
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002757.15
LogP ≤ 540.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole?
The IUPAC name of 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole (CID 159230949) is 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole.
What is the SMILES notation for 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole?
The canonical SMILES for 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole is c1ccc(-c2nc(-n3c4ccccc4c4c5ccccc5ccc43)nc3c(-c4ccccc4)nc(-n4c5ccccc5c5c6ccccc6ccc54)nc23)cc1.c1ccc(-c2nc(-n3c4ccccc4c4cnccc43)nc3c(-c4ccccc4)nc(-n4c5ccccc5c5cnccc54)nc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1nc(-n2c3ccccc3c3ccccc32)c2nc(-n3c4ccccc4c4ccccc43)nc(-n3c4ccccc4c4ccccc43)c2n1.c1ccc2c(c1)c1ccccc1n2-c1nc(N2CCOCC2)c2nc(-n3c4ccccc4c4ccccc43)nc(N3CCOCC3)c2n1.
What is the InChIKey of 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole?
The InChIKey is KSWTYNLUCJXQHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H32N8.C50H30N6.C40H24N8.C38H32N8O2/c1-9-25-41-33(17-1)34-18-2-10-26-42(34)59(41)51-49-50(56-53(57-51)61-45-29-13-5-21-37(45)38-22-6-14-30-46(38)61)52(60-43-27-11-3-19-35(43)36-20-4-12-28-44(36)60)58-54(55-49)62-47-31-15-7-23-39(47)40-24-8-16-32-48(40)62;1-3-17-33(18-4-1)45-47-48(54-49(51-45)55-39-25-13-11-23-37(39)43-35-21-9-7-15-31(35)27-29-41(43)55)46(34-19-5-2-6-20-34)52-50(53-47)56-40-26-14-12-24-38(40)44-36-22-10-8-16-32(36)28-30-42(44)56;1-3-11-25(12-4-1)35-37-38(46-39(43-35)47-31-17-9-7-15-27(31)29-23-41-21-19-33(29)47)36(26-13-5-2-6-14-26)44-40(45-37)48-32-18-10-8-16-28(32)30-24-42-22-20-34(30)48;1-5-13-29-25(9-1)26-10-2-6-14-30(26)45(29)37-39-33-34(35(41-37)43-17-21-47-22-18-43)40-38(42-36(33)44-19-23-48-24-20-44)46-31-15-7-3-11-27(31)28-12-4-8-16-32(28)46/h1-32H;1-30H;1-24H;1-16H,17-24H2.
What are the key properties of 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole?
7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole has a molecular weight of 2757.15 g/mol, XLogP of 40.09, 16 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-benzo[c]carbazol-7-yl-4,8-diphenylpyrimido[5,4-d]pyrimidin-6-yl)benzo[c]carbazole;4-[2,6-di(carbazol-9-yl)-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl]morpholine;5-(4,8-diphenyl-2-pyrido[4,3-b]indol-5-ylpyrimido[5,4-d]pyrimidin-6-yl)pyrido[4,3-b]indole;9-[2,4,6-tri(carbazol-9-yl)pyrimido[5,4-d]pyrimidin-8-yl]carbazole is sourced from PubChem (CID 159230949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).