10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole

C37H26N4 — CID 155392899

IUPAC10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole
SMILESC=C1Nc2c(ccc3c4ccccc4n(-c4cc(-c5ccccc5)cc(-c5ccccc5)n4)c23)N1c1ccccc1
InChIInChI=1S/C37H26N4/c1-25-38-36-34(40(25)29-17-9-4-10-18-29)22-21-31-30-19-11-12-20-33(30)41(37(31)36)35-24-28(26-13-5-2-6-14-26)23-32(39-35)27-15-7-3-8-16-27/h2-24,38H,1H2
InChIKeyCPKJCBXWTUAPAK-UHFFFAOYSA-N
MW526.64 g/mol
LogP9.55
Rot. Bonds4

About 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole

10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole (PubChem CID 155392899) has the molecular formula C37H26N4 and a molecular weight of 526.64 g/mol. Its IUPAC name is 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole.

Molecular Properties

Compound Name10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole
PubChem CID155392899
Molecular FormulaC37H26N4
Molecular Weight526.64 g/mol
Exact Mass526.22
IUPAC Name10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole
SMILESC=C1Nc2c(ccc3c4ccccc4n(-c4cc(-c5ccccc5)cc(-c5ccccc5)n4)c23)N1c1ccccc1
InChIInChI=1S/C37H26N4/c1-25-38-36-34(40(25)29-17-9-4-10-18-29)22-21-31-30-19-11-12-20-33(30)41(37(31)36)35-24-28(26-13-5-2-6-14-26)23-32(39-35)27-15-7-3-8-16-27/h2-24,38H,1H2
InChIKeyCPKJCBXWTUAPAK-UHFFFAOYSA-N
XLogP9.55
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500526.64
LogP ≤ 59.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

12-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 118501935
19-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9,19-diazaoctacyclo[15.15.0.02,10.03,8.011,16.018,26.020,25.027,32]dotriaconta-1(17),2(10),3,5,7,11,13,15,18(26),20,22,24,27,29,31-pentadecaene
CID 140913938
24-(4,6-diphenyl-2-pyridinyl)-24-azahexacyclo[12.11.0.02,11.05,10.017,25.018,23]pentacosa-1(14),2(11),3,5,7,9,12,15,17(25),18,20,22-dodecaene
CID 121432196
10-(2,6-diphenylpyrimidin-4-yl)-3-phenyl-1,2-dihydrotriazolo[4,5-a]carbazole
CID 122660084
12-(4-carbazol-9-ylphenyl)-5-(4,6-diphenyl-2-pyridinyl)indolo[3,2-c]carbazole
CID 144650064
2-[9-(4,6-diphenyl-2-pyridinyl)carbazol-2-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 71286771
23-(4,6-diphenyl-2-pyridinyl)-3,19-diphenyl-3,19,23-triazahexacyclo[11.10.0.02,10.04,9.014,22.016,20]tricosa-1(13),2(10),4,6,8,11,14(22),15,17,20-decaene
CID 90267340
12-[4-(4,6-diphenyl-2-pyridinyl)naphthalen-1-yl]-11-phenylindolo[2,3-a]carbazole
CID 155240123
2-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole
CID 71286768
11-(3-phenylphenyl)-12-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[2,3-a]carbazole;11-(3-phenylphenyl)-12-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]indolo[2,3-a]carbazole;11-(3-phenylphenyl)-12-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]indolo[2,3-a]carbazole;11-(3-phenylphenyl)-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 162151887
12-[4,6-bis(3-phenylphenyl)-2-pyridinyl]-1,12-diazaheptacyclo[14.12.0.02,14.05,13.06,11.017,22.023,28]octacosa-2(14),3,5(13),6,8,10,15,17,19,21,23,25,27-tridecaene
CID 118330758
12-carbazol-9-yl-11-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]indolo[2,3-a]carbazole;12-carbazol-9-yl-11-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]indolo[2,3-a]carbazole;12-carbazol-9-yl-11-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 159889633

Frequently Asked Questions

What is the IUPAC name of 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole?
The IUPAC name of 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole (CID 155392899) is 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole.
What is the SMILES notation for 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole?
The canonical SMILES for 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole is C=C1Nc2c(ccc3c4ccccc4n(-c4cc(-c5ccccc5)cc(-c5ccccc5)n4)c23)N1c1ccccc1.
What is the InChIKey of 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole?
The InChIKey is CPKJCBXWTUAPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26N4/c1-25-38-36-34(40(25)29-17-9-4-10-18-29)22-21-31-30-19-11-12-20-33(30)41(37(31)36)35-24-28(26-13-5-2-6-14-26)23-32(39-35)27-15-7-3-8-16-27/h2-24,38H,1H2.
What are the key properties of 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole?
10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole has a molecular weight of 526.64 g/mol, XLogP of 9.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4,6-diphenyl-2-pyridinyl)-2-methylidene-3-phenyl-1H-imidazo[4,5-a]carbazole is sourced from PubChem (CID 155392899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).