N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole

C173H113N23 — CID 158641050

IUPACN,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncccn6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncncn6)c5c43)n2)cc1.c1ccc(-c2ccnc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)n3)cc2)cc1
InChIInChI=1S/C64H44N6.C38H24N6.C37H23N7.C34H22N4/c1-6-20-47(21-7-1)67(48-22-8-2-9-23-48)52-38-34-45(35-39-52)58-44-59(46-36-40-53(41-37-46)68(49-24-10-3-11-25-49)50-26-12-4-13-27-50)66-64(65-58)70-61-33-19-17-31-55(61)57-43-42-56-54-30-16-18-32-60(54)69(62(56)63(57)70)51-28-14-5-15-29-51;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)42-38(41-31)44-34-19-10-8-17-28(34)30-21-20-29-27-16-7-9-18-33(27)43(35(29)36(30)44)37-39-22-11-23-40-37;1-3-11-24(12-4-1)30-21-31(25-13-5-2-6-14-25)42-37(41-30)44-33-18-10-8-16-27(33)29-20-19-28-26-15-7-9-17-32(26)43(34(28)35(29)44)36-39-22-38-23-40-36;1-3-11-23(12-4-1)29-21-22-35-34(36-29)38-31-18-10-8-16-26(31)28-20-19-27-25-15-7-9-17-30(25)37(32(27)33(28)38)24-13-5-2-6-14-24/h1-44H;1-24H;1-23H;1-22H
InChIKeyIAJSRSDJDBYEAP-UHFFFAOYSA-N
MW2513.97 g/mol
LogP42.27
Rot. Bonds21

About N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole

N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole (PubChem CID 158641050) has the molecular formula C173H113N23 and a molecular weight of 2513.97 g/mol. Its IUPAC name is N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole.

Molecular Properties

Compound NameN,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole
PubChem CID158641050
Molecular FormulaC173H113N23
Molecular Weight2513.97 g/mol
Exact Mass2511.95
IUPAC NameN,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncccn6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncncn6)c5c43)n2)cc1.c1ccc(-c2ccnc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)n3)cc2)cc1
InChIInChI=1S/C64H44N6.C38H24N6.C37H23N7.C34H22N4/c1-6-20-47(21-7-1)67(48-22-8-2-9-23-48)52-38-34-45(35-39-52)58-44-59(46-36-40-53(41-37-46)68(49-24-10-3-11-25-49)50-26-12-4-13-27-50)66-64(65-58)70-61-33-19-17-31-55(61)57-43-42-56-54-30-16-18-32-60(54)69(62(56)63(57)70)51-28-14-5-15-29-51;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)42-38(41-31)44-34-19-10-8-17-28(34)30-21-20-29-27-16-7-9-18-33(27)43(35(29)36(30)44)37-39-22-11-23-40-37;1-3-11-24(12-4-1)30-21-31(25-13-5-2-6-14-25)42-37(41-30)44-33-18-10-8-16-27(33)29-20-19-28-26-15-7-9-17-32(26)43(34(28)35(29)44)36-39-22-38-23-40-36;1-3-11-23(12-4-1)29-21-22-35-34(36-29)38-31-18-10-8-16-26(31)28-20-19-27-25-15-7-9-17-30(25)37(32(27)33(28)38)24-13-5-2-6-14-24/h1-44H;1-24H;1-23H;1-22H
InChIKeyIAJSRSDJDBYEAP-UHFFFAOYSA-N
XLogP42.27
TPSA213.49 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds21
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002513.97
LogP ≤ 542.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole with MolForge

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Related Compounds

12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole
CID 158348799
11,12-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[4-[4-(N-phenylanilino)phenyl]-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]aniline;11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole
CID 160912258
12-[2-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-4-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]aniline;11-(2,6-diphenyl-4-pyridinyl)-12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazole;11-(2,6-diphenyl-4-pyridinyl)-12-pyrimidin-2-ylindolo[2,3-a]carbazole;11-(2,6-diphenyl-4-pyridinyl)-12-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(2-phenyl-4-pyridinyl)indolo[2,3-a]carbazole
CID 158658229
12-[4,6-bis(6-phenyl-3-pyridinyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole
CID 58142345
12-(2,6-diphenyl-4-pyridinyl)-11-pyridin-4-ylindolo[2,3-a]carbazole;12-(2,6-diphenylpyrimidin-4-yl)-11-pyrimidin-4-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole
CID 158770027
bis(11,12-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-pyridin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole
CID 159279543
2-[6-(5,11-diphenylindolo[3,2-b]carbazol-2-yl)-9-(1,3,5-triazin-2-yl)carbazol-3-yl]-5-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[3,2-b]carbazole
CID 118503236
3-phenyl-24-(4-phenylpyrimidin-2-yl)-3,18,21,24-tetrazahexacyclo[11.11.0.02,10.04,9.014,23.017,22]tetracosa-1(13),2(10),4,6,8,11,14(23),15,17,19,21-undecaene
CID 122525277
4-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-N,N-diphenylaniline
CID 118506873
5-(4,6-diphenylpyrimidin-2-yl)-7-phenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)indolo[2,3-b]carbazol-3-amine
CID 122461290
3-[6-[5-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[3,2-b]carbazol-2-yl]-9-(1,3,5-triazin-2-yl)carbazol-3-yl]-12-phenyl-[1]benzothiolo[2,3-a]carbazole
CID 118503313
9-(4,6-diphenylpyrimidin-2-yl)-7-(9-phenylcarbazol-1-yl)pyrido[2,3-b]indole
CID 118587670

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?
The IUPAC name of N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole (CID 158641050) is N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole.
What is the SMILES notation for N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?
The canonical SMILES for N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncccn6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncncn6)c5c43)n2)cc1.c1ccc(-c2ccnc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)n3)cc2)cc1.
What is the InChIKey of N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?
The InChIKey is IAJSRSDJDBYEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H44N6.C38H24N6.C37H23N7.C34H22N4/c1-6-20-47(21-7-1)67(48-22-8-2-9-23-48)52-38-34-45(35-39-52)58-44-59(46-36-40-53(41-37-46)68(49-24-10-3-11-25-49)50-26-12-4-13-27-50)66-64(65-58)70-61-33-19-17-31-55(61)57-43-42-56-54-30-16-18-32-60(54)69(62(56)63(57)70)51-28-14-5-15-29-51;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)42-38(41-31)44-34-19-10-8-17-28(34)30-21-20-29-27-16-7-9-18-33(27)43(35(29)36(30)44)37-39-22-11-23-40-37;1-3-11-24(12-4-1)30-21-31(25-13-5-2-6-14-25)42-37(41-30)44-33-18-10-8-16-27(33)29-20-19-28-26-15-7-9-17-32(26)43(34(28)35(29)44)36-39-22-38-23-40-36;1-3-11-23(12-4-1)29-21-22-35-34(36-29)38-31-18-10-8-16-26(31)28-20-19-27-25-15-7-9-17-30(25)37(32(27)33(28)38)24-13-5-2-6-14-24/h1-44H;1-24H;1-23H;1-22H.
What are the key properties of N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?
N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole has a molecular weight of 2513.97 g/mol, XLogP of 42.27, 21 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole is sourced from PubChem (CID 158641050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).