2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline

C24H21N3 — CID 70652117

IUPAC2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline
SMILESCc1cc(C)c(-c2nc3ccc(C)cc3c3nc4ccccc4n23)c(C)c1
InChIInChI=1S/C24H21N3/c1-14-9-10-19-18(13-14)23-26-20-7-5-6-8-21(20)27(23)24(25-19)22-16(3)11-15(2)12-17(22)4/h5-13H,1-4H3
InChIKeyGQQDHPRTQDFJLV-UHFFFAOYSA-N
MW351.45 g/mol
LogP5.94
Rot. Bonds1

About 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline

2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline (PubChem CID 70652117) has the molecular formula C24H21N3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline.

Molecular Properties

Compound Name2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline
PubChem CID70652117
Molecular FormulaC24H21N3
Molecular Weight351.45 g/mol
Exact Mass351.17
IUPAC Name2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline
SMILESCc1cc(C)c(-c2nc3ccc(C)cc3c3nc4ccccc4n23)c(C)c1
InChIInChI=1S/C24H21N3/c1-14-9-10-19-18(13-14)23-26-20-7-5-6-8-21(20)27(23)24(25-19)22-16(3)11-15(2)12-17(22)4/h5-13H,1-4H3
InChIKeyGQQDHPRTQDFJLV-UHFFFAOYSA-N
XLogP5.94
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.45
LogP ≤ 55.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline?
The IUPAC name of 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline (CID 70652117) is 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline.
What is the SMILES notation for 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline?
The canonical SMILES for 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline is Cc1cc(C)c(-c2nc3ccc(C)cc3c3nc4ccccc4n23)c(C)c1.
What is the InChIKey of 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline?
The InChIKey is GQQDHPRTQDFJLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3/c1-14-9-10-19-18(13-14)23-26-20-7-5-6-8-21(20)27(23)24(25-19)22-16(3)11-15(2)12-17(22)4/h5-13H,1-4H3.
What are the key properties of 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline?
2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline has a molecular weight of 351.45 g/mol, XLogP of 5.94, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2,4,6-trimethylphenyl)benzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 70652117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).