6-imidazol-1-yl-2-phenylquinazoline

C17H12N4 — CID 24898732

IUPAC6-imidazol-1-yl-2-phenylquinazoline
SMILESc1ccc(-c2ncc3cc(-n4ccnc4)ccc3n2)cc1
InChIInChI=1S/C17H12N4/c1-2-4-13(5-3-1)17-19-11-14-10-15(6-7-16(14)20-17)21-9-8-18-12-21/h1-12H
InChIKeyCSZGXYBGYFNSCO-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.48
Rot. Bonds2

About 6-imidazol-1-yl-2-phenylquinazoline

6-imidazol-1-yl-2-phenylquinazoline (PubChem CID 24898732) has the molecular formula C17H12N4 and a molecular weight of 272.31 g/mol. Its IUPAC name is 6-imidazol-1-yl-2-phenylquinazoline.

Molecular Properties

Compound Name6-imidazol-1-yl-2-phenylquinazoline
PubChem CID24898732
Molecular FormulaC17H12N4
Molecular Weight272.31 g/mol
Exact Mass272.11
IUPAC Name6-imidazol-1-yl-2-phenylquinazoline
SMILESc1ccc(-c2ncc3cc(-n4ccnc4)ccc3n2)cc1
InChIInChI=1S/C17H12N4/c1-2-4-13(5-3-1)17-19-11-14-10-15(6-7-16(14)20-17)21-9-8-18-12-21/h1-12H
InChIKeyCSZGXYBGYFNSCO-UHFFFAOYSA-N
XLogP3.48
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-2-phenylquinazoline?
The IUPAC name of 6-imidazol-1-yl-2-phenylquinazoline (CID 24898732) is 6-imidazol-1-yl-2-phenylquinazoline.
What is the SMILES notation for 6-imidazol-1-yl-2-phenylquinazoline?
The canonical SMILES for 6-imidazol-1-yl-2-phenylquinazoline is c1ccc(-c2ncc3cc(-n4ccnc4)ccc3n2)cc1.
What is the InChIKey of 6-imidazol-1-yl-2-phenylquinazoline?
The InChIKey is CSZGXYBGYFNSCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4/c1-2-4-13(5-3-1)17-19-11-14-10-15(6-7-16(14)20-17)21-9-8-18-12-21/h1-12H.
What are the key properties of 6-imidazol-1-yl-2-phenylquinazoline?
6-imidazol-1-yl-2-phenylquinazoline has a molecular weight of 272.31 g/mol, XLogP of 3.48, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-2-phenylquinazoline is sourced from PubChem (CID 24898732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).