9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine

C190H127N23S2 — CID 159368132

IUPAC9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine
SMILESCC1(C)c2cc(-c3cccnc3-c3cccnc3)ccc2-c2cc3c(cc21)-c1ccc(-c2cccnc2-c2cccnc2)cc1C3(C)C.c1ccc(-n2c3ccc(-c4cccnc4-c4cccnc4)cc3c3cc(-c4cccnc4-c4cccnc4)ccc32)cc1.c1cncc(-c2ncccc2-c2c3ccccc3c(-c3cccnc3-c3cccnc3)c3ccccc23)c1.c1cncc(-c2ncccc2-c2ccc3c4ccc(-c5cccnc5-c5cccnc5)cc4c4ccccc4c3c2)c1.c1cncc(-c2ncccc2-c2ncc(-c3ccc(-c4cnc(-c5cccnc5-c5cccnc5)s4)c4ccccc34)s2)c1
InChIInChI=1S/C44H34N4.C38H25N5.C38H24N4.C36H22N6S2.C34H22N4/c1-43(2)37-21-27(31-11-7-19-47-41(31)29-9-5-17-45-25-29)13-15-33(37)35-24-40-36(23-39(35)43)34-16-14-28(22-38(34)44(40,3)4)32-12-8-20-48-42(32)30-10-6-18-46-26-30;1-2-10-30(11-3-1)43-35-16-14-26(31-12-6-20-41-37(31)28-8-4-18-39-24-28)22-33(35)34-23-27(15-17-36(34)43)32-13-7-21-42-38(32)29-9-5-19-40-25-29;1-2-10-32-31(9-1)35-21-25(29-11-5-19-41-37(29)27-7-3-17-39-23-27)13-15-33(35)34-16-14-26(22-36(32)34)30-12-6-20-42-38(30)28-8-4-18-40-24-28;1-2-10-26-25(9-1)27(31-21-41-35(43-31)29-11-5-17-39-33(29)23-7-3-15-37-19-23)13-14-28(26)32-22-42-36(44-32)30-12-6-18-40-34(30)24-8-4-16-38-20-24;1-2-12-26-25(11-1)31(29-15-7-19-37-33(29)23-9-5-17-35-21-23)27-13-3-4-14-28(27)32(26)30-16-8-20-38-34(30)24-10-6-18-36-22-24/h5-26H,1-4H3;1-25H;1-24H;1-22H;1-22H
InChIKeyLJJSSECUPLVTBW-UHFFFAOYSA-N
MW2796.40 g/mol
LogP46.55
Rot. Bonds23

About 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine

9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine (PubChem CID 159368132) has the molecular formula C190H127N23S2 and a molecular weight of 2796.40 g/mol. Its IUPAC name is 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine.

Molecular Properties

Compound Name9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine
PubChem CID159368132
Molecular FormulaC190H127N23S2
Molecular Weight2796.40 g/mol
Exact Mass2794.01
IUPAC Name9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine
SMILESCC1(C)c2cc(-c3cccnc3-c3cccnc3)ccc2-c2cc3c(cc21)-c1ccc(-c2cccnc2-c2cccnc2)cc1C3(C)C.c1ccc(-n2c3ccc(-c4cccnc4-c4cccnc4)cc3c3cc(-c4cccnc4-c4cccnc4)ccc32)cc1.c1cncc(-c2ncccc2-c2c3ccccc3c(-c3cccnc3-c3cccnc3)c3ccccc23)c1.c1cncc(-c2ncccc2-c2ccc3c4ccc(-c5cccnc5-c5cccnc5)cc4c4ccccc4c3c2)c1.c1cncc(-c2ncccc2-c2ncc(-c3ccc(-c4cnc(-c5cccnc5-c5cccnc5)s4)c4ccccc34)s2)c1
InChIInChI=1S/C44H34N4.C38H25N5.C38H24N4.C36H22N6S2.C34H22N4/c1-43(2)37-21-27(31-11-7-19-47-41(31)29-9-5-17-45-25-29)13-15-33(37)35-24-40-36(23-39(35)43)34-16-14-28(22-38(34)44(40,3)4)32-12-8-20-48-42(32)30-10-6-18-46-26-30;1-2-10-30(11-3-1)43-35-16-14-26(31-12-6-20-41-37(31)28-8-4-18-39-24-28)22-33(35)34-23-27(15-17-36(34)43)32-13-7-21-42-38(32)29-9-5-19-40-25-29;1-2-10-32-31(9-1)35-21-25(29-11-5-19-41-37(29)27-7-3-17-39-23-27)13-15-33(35)34-16-14-26(22-36(32)34)30-12-6-20-42-38(30)28-8-4-18-40-24-28;1-2-10-26-25(9-1)27(31-21-41-35(43-31)29-11-5-17-39-33(29)23-7-3-15-37-19-23)13-14-28(26)32-22-42-36(44-32)30-12-6-18-40-34(30)24-8-4-16-38-20-24;1-2-12-26-25(11-1)31(29-15-7-19-37-33(29)23-9-5-17-35-21-23)27-13-3-4-14-28(27)32(26)30-16-8-20-38-34(30)24-10-6-18-36-22-24/h5-26H,1-4H3;1-25H;1-24H;1-22H;1-22H
InChIKeyLJJSSECUPLVTBW-UHFFFAOYSA-N
XLogP46.55
TPSA288.51 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds23
Heavy Atoms215
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002796.40
LogP ≤ 546.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine?
The IUPAC name of 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine (CID 159368132) is 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine.
What is the SMILES notation for 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine?
The canonical SMILES for 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine is CC1(C)c2cc(-c3cccnc3-c3cccnc3)ccc2-c2cc3c(cc21)-c1ccc(-c2cccnc2-c2cccnc2)cc1C3(C)C.c1ccc(-n2c3ccc(-c4cccnc4-c4cccnc4)cc3c3cc(-c4cccnc4-c4cccnc4)ccc32)cc1.c1cncc(-c2ncccc2-c2c3ccccc3c(-c3cccnc3-c3cccnc3)c3ccccc23)c1.c1cncc(-c2ncccc2-c2ccc3c4ccc(-c5cccnc5-c5cccnc5)cc4c4ccccc4c3c2)c1.c1cncc(-c2ncccc2-c2ncc(-c3ccc(-c4cnc(-c5cccnc5-c5cccnc5)s4)c4ccccc34)s2)c1.
What is the InChIKey of 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine?
The InChIKey is LJJSSECUPLVTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H34N4.C38H25N5.C38H24N4.C36H22N6S2.C34H22N4/c1-43(2)37-21-27(31-11-7-19-47-41(31)29-9-5-17-45-25-29)13-15-33(37)35-24-40-36(23-39(35)43)34-16-14-28(22-38(34)44(40,3)4)32-12-8-20-48-42(32)30-10-6-18-46-26-30;1-2-10-30(11-3-1)43-35-16-14-26(31-12-6-20-41-37(31)28-8-4-18-39-24-28)22-33(35)34-23-27(15-17-36(34)43)32-13-7-21-42-38(32)29-9-5-19-40-25-29;1-2-10-32-31(9-1)35-21-25(29-11-5-19-41-37(29)27-7-3-17-39-23-27)13-15-33(35)34-16-14-26(22-36(32)34)30-12-6-20-42-38(30)28-8-4-18-40-24-28;1-2-10-26-25(9-1)27(31-21-41-35(43-31)29-11-5-17-39-33(29)23-7-3-15-37-19-23)13-14-28(26)32-22-42-36(44-32)30-12-6-18-40-34(30)24-8-4-16-38-20-24;1-2-12-26-25(11-1)31(29-15-7-19-37-33(29)23-9-5-17-35-21-23)27-13-3-4-14-28(27)32(26)30-16-8-20-38-34(30)24-10-6-18-36-22-24/h5-26H,1-4H3;1-25H;1-24H;1-22H;1-22H.
What are the key properties of 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine?
9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine has a molecular weight of 2796.40 g/mol, XLogP of 46.55, 23 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-3,6-bis(2-pyridin-3-yl-3-pyridinyl)carbazole;2-pyridin-3-yl-3-[10-(2-pyridin-3-yl-3-pyridinyl)anthracen-9-yl]pyridine;2-(2-pyridin-3-yl-3-pyridinyl)-5-[4-[2-(2-pyridin-3-yl-3-pyridinyl)-1,3-thiazol-5-yl]naphthalen-1-yl]-1,3-thiazole;2-pyridin-3-yl-3-[7-(2-pyridin-3-yl-3-pyridinyl)triphenylen-2-yl]pyridine;2-pyridin-3-yl-3-[6,6,12,12-tetramethyl-2-(2-pyridin-3-yl-3-pyridinyl)indeno[1,2-b]fluoren-8-yl]pyridine is sourced from PubChem (CID 159368132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).