2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine

C199H127N17 — CID 158609714

IUPAC2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine
SMILESc1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)c3c(n2)-c2ccccc2C3)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)nc3c2Cc2ccccc2-3)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ncnc6c5Cc5ccccc5-6)cn4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5ncc6c(n5)Cc5ccccc5-6)c4)ccc32)cc1
InChIInChI=1S/2C53H34N4.C47H30N4.C46H29N5/c1-3-14-34(15-4-1)53-54-51(46-33-37-16-7-8-21-41(37)52(46)55-53)38-17-13-20-40(30-38)57-48-25-12-10-23-43(48)45-32-36(27-29-50(45)57)35-26-28-49-44(31-35)42-22-9-11-24-47(42)56(49)39-18-5-2-6-19-39;1-3-14-34(15-4-1)51-46-33-37-16-7-8-21-41(37)52(46)55-53(54-51)38-17-13-20-40(30-38)57-48-25-12-10-23-43(48)45-32-36(27-29-50(45)57)35-26-28-49-44(31-35)42-22-9-11-24-47(42)56(49)39-18-5-2-6-19-39;1-2-13-34(14-3-1)50-43-19-8-6-17-37(43)39-26-30(21-23-45(39)50)31-22-24-46-40(27-31)38-18-7-9-20-44(38)51(46)35-15-10-12-33(25-35)47-48-29-41-36-16-5-4-11-32(36)28-42(41)49-47;1-2-11-33(12-3-1)50-40-16-8-6-14-35(40)37-24-29(18-21-42(37)50)30-19-22-43-38(25-30)36-15-7-9-17-41(36)51(43)44-23-20-32(27-47-44)45-39-26-31-10-4-5-13-34(31)46(39)49-28-48-45/h2*1-32H,33H2;1-27,29H,28H2;1-25,27-28H,26H2
InChIKeyHWRINLHHAVZNSP-UHFFFAOYSA-N
MW2756.32 g/mol
LogP49.03
Rot. Bonds18

About 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine

2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine (PubChem CID 158609714) has the molecular formula C199H127N17 and a molecular weight of 2756.32 g/mol. Its IUPAC name is 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine.

Molecular Properties

Compound Name2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine
PubChem CID158609714
Molecular FormulaC199H127N17
Molecular Weight2756.32 g/mol
Exact Mass2754.05
IUPAC Name2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine
SMILESc1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)c3c(n2)-c2ccccc2C3)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)nc3c2Cc2ccccc2-3)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ncnc6c5Cc5ccccc5-6)cn4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5ncc6c(n5)Cc5ccccc5-6)c4)ccc32)cc1
InChIInChI=1S/2C53H34N4.C47H30N4.C46H29N5/c1-3-14-34(15-4-1)53-54-51(46-33-37-16-7-8-21-41(37)52(46)55-53)38-17-13-20-40(30-38)57-48-25-12-10-23-43(48)45-32-36(27-29-50(45)57)35-26-28-49-44(31-35)42-22-9-11-24-47(42)56(49)39-18-5-2-6-19-39;1-3-14-34(15-4-1)51-46-33-37-16-7-8-21-41(37)52(46)55-53(54-51)38-17-13-20-40(30-38)57-48-25-12-10-23-43(48)45-32-36(27-29-50(45)57)35-26-28-49-44(31-35)42-22-9-11-24-47(42)56(49)39-18-5-2-6-19-39;1-2-13-34(14-3-1)50-43-19-8-6-17-37(43)39-26-30(21-23-45(39)50)31-22-24-46-40(27-31)38-18-7-9-20-44(38)51(46)35-15-10-12-33(25-35)47-48-29-41-36-16-5-4-11-32(36)28-42(41)49-47;1-2-11-33(12-3-1)50-40-16-8-6-14-35(40)37-24-29(18-21-42(37)50)30-19-22-43-38(25-30)36-15-7-9-17-41(36)51(43)44-23-20-32(27-47-44)45-39-26-31-10-4-5-13-34(31)46(39)49-28-48-45/h2*1-32H,33H2;1-27,29H,28H2;1-25,27-28H,26H2
InChIKeyHWRINLHHAVZNSP-UHFFFAOYSA-N
XLogP49.03
TPSA155.45 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds18
Heavy Atoms216
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002756.32
LogP ≤ 549.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine with MolForge

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Related Compounds

2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-9H-indeno[2,1-d]pyrimidine;4-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-9H-indeno[2,1-d]pyrimidine;2-phenyl-4-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-9H-indeno[2,1-d]pyrimidine;4-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-5H-indeno[1,2-d]pyrimidine
CID 162133182
4-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-9H-indeno[2,1-d]pyrimidine;4-phenyl-2-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-5H-indeno[1,2-d]pyrimidine
CID 159616464
2-[3-(6,9-diphenylcarbazol-3-yl)carbazol-9-yl]-4-phenyl-5H-indeno[1,2-d]pyrimidine;4-[3-(6,9-diphenylcarbazol-3-yl)carbazol-9-yl]-2-phenyl-5H-indeno[1,2-d]pyrimidine
CID 158005802
3-(9H-fluoren-4-yl)-9-[3-[4-[3-[3-(9H-fluoren-4-yl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 162137186
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]carbazole;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 160861876
7-(3-carbazol-9-ylphenyl)-4-naphthalen-1-yl-2-phenyl-5H-indeno[1,2-d]pyrimidine
CID 142550922
2-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-5H-indeno[1,2-d]pyrimidine
CID 158215535
3-(9H-fluoren-1-yl)-9-[3-[4-[3-methyl-2-(2-methylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 145016968
2,4-diphenyl-8-[4-(9-phenylcarbazol-4-yl)phenyl]-5H-indeno[1,2-d]pyrimidine
CID 142551254
9-[3-[1-(3-carbazol-9-ylphenyl)-9H-fluoren-3-yl]phenyl]carbazole
CID 145060053
3-(9-phenylcarbazol-3-yl)-9-(5-phenyl-2-pyridinyl)carbazole
CID 118581881
3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 158317836

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine?
The IUPAC name of 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine (CID 158609714) is 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine.
What is the SMILES notation for 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine?
The canonical SMILES for 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine is c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)c3c(n2)-c2ccccc2C3)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)c3)nc3c2Cc2ccccc2-3)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ncnc6c5Cc5ccccc5-6)cn4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5ncc6c(n5)Cc5ccccc5-6)c4)ccc32)cc1.
What is the InChIKey of 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine?
The InChIKey is HWRINLHHAVZNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C53H34N4.C47H30N4.C46H29N5/c1-3-14-34(15-4-1)53-54-51(46-33-37-16-7-8-21-41(37)52(46)55-53)38-17-13-20-40(30-38)57-48-25-12-10-23-43(48)45-32-36(27-29-50(45)57)35-26-28-49-44(31-35)42-22-9-11-24-47(42)56(49)39-18-5-2-6-19-39;1-3-14-34(15-4-1)51-46-33-37-16-7-8-21-41(37)52(46)55-53(54-51)38-17-13-20-40(30-38)57-48-25-12-10-23-43(48)45-32-36(27-29-50(45)57)35-26-28-49-44(31-35)42-22-9-11-24-47(42)56(49)39-18-5-2-6-19-39;1-2-13-34(14-3-1)50-43-19-8-6-17-37(43)39-26-30(21-23-45(39)50)31-22-24-46-40(27-31)38-18-7-9-20-44(38)51(46)35-15-10-12-33(25-35)47-48-29-41-36-16-5-4-11-32(36)28-42(41)49-47;1-2-11-33(12-3-1)50-40-16-8-6-14-35(40)37-24-29(18-21-42(37)50)30-19-22-43-38(25-30)36-15-7-9-17-41(36)51(43)44-23-20-32(27-47-44)45-39-26-31-10-4-5-13-34(31)46(39)49-28-48-45/h2*1-32H,33H2;1-27,29H,28H2;1-25,27-28H,26H2.
What are the key properties of 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine?
2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine has a molecular weight of 2756.32 g/mol, XLogP of 49.03, 18 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-9H-indeno[2,1-d]pyrimidine;4-[6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-3-pyridinyl]-5H-indeno[1,2-d]pyrimidine;2-phenyl-4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine;4-phenyl-2-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-5H-indeno[1,2-d]pyrimidine is sourced from PubChem (CID 158609714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).