6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline

C32H21N3 — CID 70652103

IUPAC6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc4ccccc4c4nc5ccccc5n34)c2)cc1
InChIInChI=1S/C32H21N3/c1-3-11-22(12-4-1)24-19-25(23-13-5-2-6-14-23)21-26(20-24)31-33-28-16-8-7-15-27(28)32-34-29-17-9-10-18-30(29)35(31)32/h1-21H
InChIKeyULGPSBAXECZOKE-UHFFFAOYSA-N
MW447.54 g/mol
LogP8.04
Rot. Bonds3

About 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline

6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline (PubChem CID 70652103) has the molecular formula C32H21N3 and a molecular weight of 447.54 g/mol. Its IUPAC name is 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline.

Molecular Properties

Compound Name6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline
PubChem CID70652103
Molecular FormulaC32H21N3
Molecular Weight447.54 g/mol
Exact Mass447.17
IUPAC Name6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3nc4ccccc4c4nc5ccccc5n34)c2)cc1
InChIInChI=1S/C32H21N3/c1-3-11-22(12-4-1)24-19-25(23-13-5-2-6-14-23)21-26(20-24)31-33-28-16-8-7-15-27(28)32-34-29-17-9-10-18-30(29)35(31)32/h1-21H
InChIKeyULGPSBAXECZOKE-UHFFFAOYSA-N
XLogP8.04
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.54
LogP ≤ 58.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-[3-[3,5-bis[3-(benzimidazolo[1,2-c]quinazolin-6-yl)phenyl]phenyl]phenyl]benzimidazolo[1,2-c]quinazoline
CID 58894944
6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]benzimidazolo[1,2-c]quinazoline
CID 70807705
6-(4,6-diphenyl-2-pyridinyl)benzimidazolo[1,2-c]quinazoline
CID 70807699
6-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzimidazolo[1,2-c]quinazoline
CID 58894937
6-(4-methoxyphenyl)benzimidazolo[1,2-c]quinazoline
CID 12826322
6-[4-(10-methylanthracen-9-yl)phenyl]benzimidazolo[1,2-c]quinazoline
CID 143486488
4-[4-[6-(benzimidazolo[1,2-c]quinazolin-6-yl)naphthalen-2-yl]phenyl]benzonitrile
CID 154940310
6-[3-[3-(benzimidazolo[1,2-c]quinazolin-6-yl)phenyl]phenyl]-2-naphthalen-2-ylbenzimidazolo[1,2-c]quinazoline;2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-6-naphthalen-2-ylbenzimidazolo[1,2-c]quinazoline;2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-(4-phenylphenyl)benzimidazolo[1,2-c]quinazoline;6-naphthalen-2-yl-2-(10-naphthalen-2-ylanthracen-9-yl)benzimidazolo[1,2-c]quinazoline;2-naphthalen-2-yl-6-[3-[3-(2-naphthalen-2-ylbenzimidazolo[1,2-c]quinazolin-6-yl)phenyl]phenyl]benzimidazolo[1,2-c]quinazoline;6-[3-naphthalen-2-yl-5-(2-phenylbenzimidazolo[1,2-c]quinazolin-6-yl)phenyl]-2-phenylbenzimidazolo[1,2-c]quinazoline
CID 159359183
13-phenyl-3,10,23,30-tetrazaheptacyclo[21.7.0.02,10.04,9.011,16.017,22.024,29]triaconta-1(30),2,4,6,8,11(16),12,14,17,19,21,24,26,28-tetradecaene
CID 138474670
11-[4-[4-(3,10,12-triazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2,4,6,8,11,14,16,18,20-decaen-11-yl)phenyl]phenyl]-3,10,12-triazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2,4,6,8,11,14,16,18,20-decaene
CID 70807727
6-[2,4,6-tri(propan-2-yl)phenyl]benzimidazolo[1,2-c]quinazoline
CID 70651023
21-(3,5-diphenylphenyl)-2,9,21-triazaheptacyclo[15.11.0.02,10.03,8.011,16.020,28.022,27]octacosa-1(17),3,5,7,9,11,13,15,18,20(28),22,24,26-tridecaene
CID 90432451

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline?
The IUPAC name of 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline (CID 70652103) is 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline.
What is the SMILES notation for 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline?
The canonical SMILES for 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline is c1ccc(-c2cc(-c3ccccc3)cc(-c3nc4ccccc4c4nc5ccccc5n34)c2)cc1.
What is the InChIKey of 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline?
The InChIKey is ULGPSBAXECZOKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21N3/c1-3-11-22(12-4-1)24-19-25(23-13-5-2-6-14-23)21-26(20-24)31-33-28-16-8-7-15-27(28)32-34-29-17-9-10-18-30(29)35(31)32/h1-21H.
What are the key properties of 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline?
6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline has a molecular weight of 447.54 g/mol, XLogP of 8.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-diphenylphenyl)benzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 70652103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).