12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole

C156H98N26OS — CID 157127009

IUPAC12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4c5sc6ccccc6c5ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4ccc5c6ccccc6oc5c43)n2)cc1
InChIInChI=1S/2C42H27N7.C36H22N6O.C36H22N6S/c1-4-14-28(15-5-1)39-44-40(29-16-6-2-7-17-29)46-41(45-39)47-25-24-43-42(47)49-36-23-13-11-21-32(36)34-26-37-33(27-38(34)49)31-20-10-12-22-35(31)48(37)30-18-8-3-9-19-30;1-4-14-28(15-5-1)39-44-40(29-16-6-2-7-17-29)46-41(45-39)47-27-26-43-42(47)49-36-23-13-11-21-32(36)34-25-24-33-31-20-10-12-22-35(31)48(37(33)38(34)49)30-18-8-3-9-19-30;1-3-11-23(12-4-1)33-38-34(24-13-5-2-6-14-24)40-35(39-33)41-22-21-37-36(41)42-29-17-9-7-15-25(29)27-19-20-28-26-16-8-10-18-30(26)43-32(28)31(27)42;1-3-11-23(12-4-1)33-38-34(24-13-5-2-6-14-24)40-35(39-33)41-22-21-37-36(41)42-28-17-9-7-16-27(28)31-29(42)20-19-26-25-15-8-10-18-30(25)43-32(26)31/h2*1-27H;2*1-22H
InChIKeyAIPURILTDVYNPZ-UHFFFAOYSA-N
MW2384.75 g/mol
LogP36.42
Rot. Bonds18

About 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole

12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole (PubChem CID 157127009) has the molecular formula C156H98N26OS and a molecular weight of 2384.75 g/mol. Its IUPAC name is 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole.

Molecular Properties

Compound Name12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole
PubChem CID157127009
Molecular FormulaC156H98N26OS
Molecular Weight2384.75 g/mol
Exact Mass2382.81
IUPAC Name12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4c5sc6ccccc6c5ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4ccc5c6ccccc6oc5c43)n2)cc1
InChIInChI=1S/2C42H27N7.C36H22N6O.C36H22N6S/c1-4-14-28(15-5-1)39-44-40(29-16-6-2-7-17-29)46-41(45-39)47-25-24-43-42(47)49-36-23-13-11-21-32(36)34-26-37-33(27-38(34)49)31-20-10-12-22-35(31)48(37)30-18-8-3-9-19-30;1-4-14-28(15-5-1)39-44-40(29-16-6-2-7-17-29)46-41(45-39)47-27-26-43-42(47)49-36-23-13-11-21-32(36)34-25-24-33-31-20-10-12-22-35(31)48(37(33)38(34)49)30-18-8-3-9-19-30;1-3-11-23(12-4-1)33-38-34(24-13-5-2-6-14-24)40-35(39-33)41-22-21-37-36(41)42-29-17-9-7-15-25(29)27-19-20-28-26-16-8-10-18-30(26)43-32(28)31(27)42;1-3-11-23(12-4-1)33-38-34(24-13-5-2-6-14-24)40-35(39-33)41-22-21-37-36(41)42-28-17-9-7-16-27(28)31-29(42)20-19-26-25-15-8-10-18-30(25)43-32(26)31/h2*1-27H;2*1-22H
InChIKeyAIPURILTDVYNPZ-UHFFFAOYSA-N
XLogP36.42
TPSA268.68 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds18
Heavy Atoms184
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002384.75
LogP ≤ 536.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole?
The IUPAC name of 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole (CID 157127009) is 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole.
What is the SMILES notation for 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole?
The canonical SMILES for 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4c5sc6ccccc6c5ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3ccnc3-n3c4ccccc4c4ccc5c6ccccc6oc5c43)n2)cc1.
What is the InChIKey of 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole?
The InChIKey is AIPURILTDVYNPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C42H27N7.C36H22N6O.C36H22N6S/c1-4-14-28(15-5-1)39-44-40(29-16-6-2-7-17-29)46-41(45-39)47-25-24-43-42(47)49-36-23-13-11-21-32(36)34-26-37-33(27-38(34)49)31-20-10-12-22-35(31)48(37)30-18-8-3-9-19-30;1-4-14-28(15-5-1)39-44-40(29-16-6-2-7-17-29)46-41(45-39)47-27-26-43-42(47)49-36-23-13-11-21-32(36)34-25-24-33-31-20-10-12-22-35(31)48(37(33)38(34)49)30-18-8-3-9-19-30;1-3-11-23(12-4-1)33-38-34(24-13-5-2-6-14-24)40-35(39-33)41-22-21-37-36(41)42-29-17-9-7-15-25(29)27-19-20-28-26-16-8-10-18-30(26)43-32(28)31(27)42;1-3-11-23(12-4-1)33-38-34(24-13-5-2-6-14-24)40-35(39-33)41-22-21-37-36(41)42-28-17-9-7-16-27(28)31-29(42)20-19-26-25-15-8-10-18-30(25)43-32(26)31/h2*1-27H;2*1-22H.
What are the key properties of 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole?
12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole has a molecular weight of 2384.75 g/mol, XLogP of 36.42, 18 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzofuro[2,3-a]carbazole;5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-[1]benzothiolo[3,2-c]carbazole;12-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-11-phenylindolo[2,3-a]carbazole;11-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)imidazol-2-yl]-5-phenylindolo[3,2-b]carbazole is sourced from PubChem (CID 157127009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).