4-phenyl-6-quinolin-3-ylquinazoline

C23H15N3 — CID 155542800

IUPAC4-phenyl-6-quinolin-3-ylquinazoline
SMILESc1ccc(-c2ncnc3ccc(-c4cnc5ccccc5c4)cc23)cc1
InChIInChI=1S/C23H15N3/c1-2-6-16(7-3-1)23-20-13-17(10-11-22(20)25-15-26-23)19-12-18-8-4-5-9-21(18)24-14-19/h1-15H
InChIKeyTUVDBYMABYAKCP-UHFFFAOYSA-N
MW333.39 g/mol
LogP5.51
Rot. Bonds2

About 4-phenyl-6-quinolin-3-ylquinazoline

4-phenyl-6-quinolin-3-ylquinazoline (PubChem CID 155542800) has the molecular formula C23H15N3 and a molecular weight of 333.39 g/mol. Its IUPAC name is 4-phenyl-6-quinolin-3-ylquinazoline.

Molecular Properties

Compound Name4-phenyl-6-quinolin-3-ylquinazoline
PubChem CID155542800
Molecular FormulaC23H15N3
Molecular Weight333.39 g/mol
Exact Mass333.13
IUPAC Name4-phenyl-6-quinolin-3-ylquinazoline
SMILESc1ccc(-c2ncnc3ccc(-c4cnc5ccccc5c4)cc23)cc1
InChIInChI=1S/C23H15N3/c1-2-6-16(7-3-1)23-20-13-17(10-11-22(20)25-15-26-23)19-12-18-8-4-5-9-21(18)24-14-19/h1-15H
InChIKeyTUVDBYMABYAKCP-UHFFFAOYSA-N
XLogP5.51
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.39
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-quinolin-3-ylquinazoline?
The IUPAC name of 4-phenyl-6-quinolin-3-ylquinazoline (CID 155542800) is 4-phenyl-6-quinolin-3-ylquinazoline.
What is the SMILES notation for 4-phenyl-6-quinolin-3-ylquinazoline?
The canonical SMILES for 4-phenyl-6-quinolin-3-ylquinazoline is c1ccc(-c2ncnc3ccc(-c4cnc5ccccc5c4)cc23)cc1.
What is the InChIKey of 4-phenyl-6-quinolin-3-ylquinazoline?
The InChIKey is TUVDBYMABYAKCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3/c1-2-6-16(7-3-1)23-20-13-17(10-11-22(20)25-15-26-23)19-12-18-8-4-5-9-21(18)24-14-19/h1-15H.
What are the key properties of 4-phenyl-6-quinolin-3-ylquinazoline?
4-phenyl-6-quinolin-3-ylquinazoline has a molecular weight of 333.39 g/mol, XLogP of 5.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-6-quinolin-3-ylquinazoline is sourced from PubChem (CID 155542800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).