11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole

C126H90N12 — CID 158857486

IUPAC11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole
SMILESCC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cn4)c3c21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cn4)c3c21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4cnc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)cn4)c3c21
InChIInChI=1S/C44H32N2.2C41H29N5/c1-44(2)39-19-11-9-17-35(39)37-22-23-38-36-18-10-12-20-40(36)46(43(38)42(37)44)41-24-21-31(28-45-41)34-26-32(29-13-5-3-6-14-29)25-33(27-34)30-15-7-4-8-16-30;1-41(2)33-19-11-9-17-29(33)31-22-23-32-30-18-10-12-20-34(30)46(37(32)36(31)41)35-24-21-28(25-42-35)40-44-38(26-13-5-3-6-14-26)43-39(45-40)27-15-7-4-8-16-27;1-41(2)32-19-11-9-17-28(32)30-21-22-31-29-18-10-12-20-36(29)46(39(31)38(30)41)37-25-42-35(24-43-37)40-44-33(26-13-5-3-6-14-26)23-34(45-40)27-15-7-4-8-16-27/h3-28H,1-2H3;2*3-25H,1-2H3
InChIKeyJAFUYTAXDHVQFK-UHFFFAOYSA-N
MW1772.19 g/mol
LogP30.83
Rot. Bonds12

About 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole

11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole (PubChem CID 158857486) has the molecular formula C126H90N12 and a molecular weight of 1772.19 g/mol. Its IUPAC name is 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole.

Molecular Properties

Compound Name11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole
PubChem CID158857486
Molecular FormulaC126H90N12
Molecular Weight1772.19 g/mol
Exact Mass1770.74
IUPAC Name11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole
SMILESCC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cn4)c3c21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cn4)c3c21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4cnc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)cn4)c3c21
InChIInChI=1S/C44H32N2.2C41H29N5/c1-44(2)39-19-11-9-17-35(39)37-22-23-38-36-18-10-12-20-40(36)46(43(38)42(37)44)41-24-21-31(28-45-41)34-26-32(29-13-5-3-6-14-29)25-33(27-34)30-15-7-4-8-16-30;1-41(2)33-19-11-9-17-29(33)31-22-23-32-30-18-10-12-20-34(30)46(37(32)36(31)41)35-24-21-28(25-42-35)40-44-38(26-13-5-3-6-14-26)43-39(45-40)27-15-7-4-8-16-27;1-41(2)32-19-11-9-17-28(32)30-21-22-31-29-18-10-12-20-36(29)46(39(31)38(30)41)37-25-42-35(24-43-37)40-44-33(26-13-5-3-6-14-26)23-34(45-40)27-15-7-4-8-16-27/h3-28H,1-2H3;2*3-25H,1-2H3
InChIKeyJAFUYTAXDHVQFK-UHFFFAOYSA-N
XLogP30.83
TPSA130.80 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001772.19
LogP ≤ 530.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole with MolForge

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Related Compounds

5-[5-(3,5-diphenylphenyl)-2-pyridinyl]-11,11-dimethylindeno[1,2-b]carbazole;5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole;5-[5-(2,6-diphenyl-4-pyridinyl)-2-pyridinyl]-11,11-dimethylindeno[1,2-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole;5-[5-(2,6-diphenylpyrimidin-4-yl)pyrazin-2-yl]-11,11-dimethylindeno[1,2-b]carbazole;5-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-11,11-dimethylindeno[1,2-b]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-11,11-dimethylindeno[1,2-b]carbazole
CID 157206903
11-[4-(3,5-diphenylphenyl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 158828400
12,12-dimethyl-11-[4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]indeno[2,1-a]carbazole
CID 163675425
11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 58059187
11-[4-[2,6-bis[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]pyrimidin-4-yl]phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 126630778
11-[3-[4,6-bis(3,5-diphenylphenyl)pyrimidin-2-yl]oxyphenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 118530590
3-(4-carbazol-9-ylphenyl)-24,24-dimethyl-3-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;12-[5-(4,6-diphenylpyrimidin-2-yl)-2-pyridinyl]-22,22-dimethyl-12-azahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(24),2,4,6,8,10,13,15(23),16,18,20-undecaene;12-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-15,15-dimethyl-12-azahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene
CID 159037595
9-[3-[2,6-bis(4-phenylphenyl)pyrimidin-4-yl]-5-(9,9-dimethylfluoren-2-yl)phenyl]carbazole
CID 67678590
12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole;11-phenyl-12-[4-(1-phenylbenzimidazol-2-yl)phenyl]indolo[2,3-a]carbazole
CID 160948499
11-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 169014731
5-[4-(3,5-diphenylphenyl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole;5-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole
CID 158211170
3-[9-[4-[6-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[6-(3,5-diphenylphenyl)-2-phenylpyrimidin-4-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 158207100

Frequently Asked Questions

What is the IUPAC name of 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole?
The IUPAC name of 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole (CID 158857486) is 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole.
What is the SMILES notation for 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole?
The canonical SMILES for 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole is CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cn4)c3c21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cn4)c3c21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4cnc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)cn4)c3c21.
What is the InChIKey of 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole?
The InChIKey is JAFUYTAXDHVQFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H32N2.2C41H29N5/c1-44(2)39-19-11-9-17-35(39)37-22-23-38-36-18-10-12-20-40(36)46(43(38)42(37)44)41-24-21-31(28-45-41)34-26-32(29-13-5-3-6-14-29)25-33(27-34)30-15-7-4-8-16-30;1-41(2)33-19-11-9-17-29(33)31-22-23-32-30-18-10-12-20-34(30)46(37(32)36(31)41)35-24-21-28(25-42-35)40-44-38(26-13-5-3-6-14-26)43-39(45-40)27-15-7-4-8-16-27;1-41(2)32-19-11-9-17-28(32)30-21-22-31-29-18-10-12-20-36(29)46(39(31)38(30)41)37-25-42-35(24-43-37)40-44-33(26-13-5-3-6-14-26)23-34(45-40)27-15-7-4-8-16-27/h3-28H,1-2H3;2*3-25H,1-2H3.
What are the key properties of 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole?
11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole has a molecular weight of 1772.19 g/mol, XLogP of 30.83, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[5-(3,5-diphenylphenyl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenylpyrimidin-2-yl)pyrazin-2-yl]-12,12-dimethylindeno[2,1-a]carbazole;11-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]-12,12-dimethylindeno[2,1-a]carbazole is sourced from PubChem (CID 158857486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).