1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole

C28H24N2 — CID 168873272

IUPAC1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole
SMILESCC(C)(C)c1cccc(-c2cccc3[nH]c4cc5c(cc4c23)[nH]c2ccccc25)c1
InChIInChI=1S/C28H24N2/c1-28(2,3)18-9-6-8-17(14-18)19-11-7-13-24-27(19)22-16-25-21(15-26(22)30-24)20-10-4-5-12-23(20)29-25/h4-16,29-30H,1-3H3
InChIKeyUTRQSXLJGHWVST-UHFFFAOYSA-N
MW388.51 g/mol
LogP7.92
Rot. Bonds1

About 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole

1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole (PubChem CID 168873272) has the molecular formula C28H24N2 and a molecular weight of 388.51 g/mol. Its IUPAC name is 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole.

Molecular Properties

Compound Name1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole
PubChem CID168873272
Molecular FormulaC28H24N2
Molecular Weight388.51 g/mol
Exact Mass388.19
IUPAC Name1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole
SMILESCC(C)(C)c1cccc(-c2cccc3[nH]c4cc5c(cc4c23)[nH]c2ccccc25)c1
InChIInChI=1S/C28H24N2/c1-28(2,3)18-9-6-8-17(14-18)19-11-7-13-24-27(19)22-16-25-21(15-26(22)30-24)20-10-4-5-12-23(20)29-25/h4-16,29-30H,1-3H3
InChIKeyUTRQSXLJGHWVST-UHFFFAOYSA-N
XLogP7.92
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.51
LogP ≤ 57.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 168948755
4-phenyl-9H-carbazole
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1,2-bis(3-tert-butylphenyl)benzene
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7,17,24,34-tetrazanonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1(20),2,4(16),5,8,10,12,14,18,21(33),22,25,27,29,31-pentadecaene
CID 58471811
3-(4-tert-butylphenyl)-9H-carbazole
CID 91473096
3-(6-tert-butyldibenzothiophen-4-yl)-9H-carbazole
CID 66800201
1-[3-(3-tert-butyl-5-phenylphenyl)phenyl]dibenzothiophene
CID 170133675
3-tert-butyl-6-dibenzothiophen-4-yl-9H-carbazole
CID 66800641
4-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-9H-carbazole
CID 121477925
9,23-bis(4-tert-butyl-2-phenylphenyl)-14,28-diazaheptacyclo[15.11.0.03,15.04,13.06,11.018,27.020,25]octacosa-1(17),2,4(13),5,7,9,11,15,18(27),19,21,23,25-tridecaene
CID 170900903
1-methoxy-5,7-dihydroindolo[2,3-b]carbazole
CID 141287625
1-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole
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Frequently Asked Questions

What is the IUPAC name of 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole?
The IUPAC name of 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole (CID 168873272) is 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole.
What is the SMILES notation for 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole?
The canonical SMILES for 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole is CC(C)(C)c1cccc(-c2cccc3[nH]c4cc5c(cc4c23)[nH]c2ccccc25)c1.
What is the InChIKey of 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole?
The InChIKey is UTRQSXLJGHWVST-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2/c1-28(2,3)18-9-6-8-17(14-18)19-11-7-13-24-27(19)22-16-25-21(15-26(22)30-24)20-10-4-5-12-23(20)29-25/h4-16,29-30H,1-3H3.
What are the key properties of 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole?
1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole has a molecular weight of 388.51 g/mol, XLogP of 7.92, 1 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-tert-butylphenyl)-5,11-dihydroindolo[3,2-b]carbazole is sourced from PubChem (CID 168873272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).