4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole

C26H18N4 — CID 164714389

IUPAC4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole
SMILESCn1c2ccccc2n2c3cccc(-n4c5ccccc5c5ccccc54)c3nc12
InChIInChI=1S/C26H18N4/c1-28-21-13-6-7-14-22(21)30-24-16-8-15-23(25(24)27-26(28)30)29-19-11-4-2-9-17(19)18-10-3-5-12-20(18)29/h2-16H,1H3
InChIKeyUALKTDDVNJWESL-UHFFFAOYSA-N
MW386.46 g/mol
LogP6.08
Rot. Bonds1

About 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole

4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole (PubChem CID 164714389) has the molecular formula C26H18N4 and a molecular weight of 386.46 g/mol. Its IUPAC name is 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole.

Molecular Properties

Compound Name4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole
PubChem CID164714389
Molecular FormulaC26H18N4
Molecular Weight386.46 g/mol
Exact Mass386.15
IUPAC Name4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole
SMILESCn1c2ccccc2n2c3cccc(-n4c5ccccc5c5ccccc54)c3nc12
InChIInChI=1S/C26H18N4/c1-28-21-13-6-7-14-22(21)30-24-16-8-15-23(25(24)27-26(28)30)29-19-11-4-2-9-17(19)18-10-3-5-12-20(18)29/h2-16H,1H3
InChIKeyUALKTDDVNJWESL-UHFFFAOYSA-N
XLogP6.08
TPSA27.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.46
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-carbazol-9-yl-9-(2-methylphenyl)carbazole
CID 174273239
3,16-dimethyl-3,14,16,23-tetrazahexacyclo[11.10.0.02,10.04,9.015,23.017,22]tricosa-1(13),2(10),4,6,8,11,14,17,19,21-decaene
CID 155082278
9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole
CID 67374081
[9-[6-(8,14-dioxa-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)benzimidazolo[1,2-a]benzimidazol-4-yl]carbazol-3-yl]-triphenylgermane
CID 170681727
3,21-bis(3-methylphenyl)-3,14,21,23-tetrazahexacyclo[11.10.0.02,10.04,9.014,22.015,20]tricosa-1(13),2(10),4,6,8,11,15,17,19,22-decaene
CID 156574320
5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole
CID 118487924
[4-[24-(3-carbazol-9-ylcarbazol-9-yl)-20,22,29-triazaheptacyclo[18.10.0.02,7.08,13.014,19.021,29.023,28]triaconta-1(30),2,4,6,8,10,12,14,16,18,21,23(28),24,26-tetradecaen-30-yl]phenyl]-triphenylsilane
CID 168811316
9-(9-carbazol-9-ylpyren-4-yl)carbazole
CID 174313049
9,13,15,17,21-pentamethyl-4,11,13,17,19,26-hexazaheptacyclo[14.10.0.03,14.04,12.05,10.018,26.020,25]hexacosa-1(16),2,5,7,9,11,14,18,20,22,24-undecaene
CID 159622123
9-[4,7-di(carbazol-9-yl)benzo[a]anthracen-12-yl]carbazole
CID 59412616
7-methyl-10-(9-naphthalen-1-ylcarbazol-3-yl)benzo[c]carbazole
CID 138662750
[6-[9-(3-carbazol-9-ylphenyl)carbazol-3-yl]benzimidazolo[1,2-a]benzimidazol-4-yl]-triphenylsilane
CID 169290711

Frequently Asked Questions

What is the IUPAC name of 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole?
The IUPAC name of 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole (CID 164714389) is 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole.
What is the SMILES notation for 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole?
The canonical SMILES for 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole is Cn1c2ccccc2n2c3cccc(-n4c5ccccc5c5ccccc54)c3nc12.
What is the InChIKey of 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole?
The InChIKey is UALKTDDVNJWESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N4/c1-28-21-13-6-7-14-22(21)30-24-16-8-15-23(25(24)27-26(28)30)29-19-11-4-2-9-17(19)18-10-3-5-12-20(18)29/h2-16H,1H3.
What are the key properties of 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole?
4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole has a molecular weight of 386.46 g/mol, XLogP of 6.08, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-carbazol-9-yl-6-methylbenzimidazolo[1,2-a]benzimidazole is sourced from PubChem (CID 164714389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).