2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one

C18H16N4O2 — CID 663919

IUPAC2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccco2)n1CCCn1ccnc1
InChIInChI=1S/C18H16N4O2/c23-18-14-5-1-2-6-15(14)20-17(16-7-3-12-24-16)22(18)10-4-9-21-11-8-19-13-21/h1-3,5-8,11-13H,4,9-10H2
InChIKeySMRWPOHCHCSTFU-UHFFFAOYSA-N
MW320.35 g/mol
LogP2.94
Rot. Bonds5

About 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one

2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one (PubChem CID 663919) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one.

Molecular Properties

Compound Name2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one
PubChem CID663919
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC Name2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccco2)n1CCCn1ccnc1
InChIInChI=1S/C18H16N4O2/c23-18-14-5-1-2-6-15(14)20-17(16-7-3-12-24-16)22(18)10-4-9-21-11-8-19-13-21/h1-3,5-8,11-13H,4,9-10H2
InChIKeySMRWPOHCHCSTFU-UHFFFAOYSA-N
XLogP2.94
TPSA65.85 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(furan-2-yl)-3-(pyridin-4-yl)quinazolin-4(3H)-one
CID 823069
N-[(Z)-2-Furan-2-yl-1-(3-imidazol-1-yl-propylcarbamoyl)-vinyl]-4-methoxy-benzamide
CID 12005525
6-[Furan-2-yl(imidazol-1-yl)methyl]-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-11-one
CID 58255637
4H-Imidazo(4,5-c)quinolin-4-one, 1,5-dihydro-5-(2-furanylmethyl)-1-methyl-
CID 3077018
N-(2-(2-Furyl)-1-(((3-(1H-imidazol-1-YL)PR)amino)carbonyl)vinyl)-4-ME-benzamide
CID 5907494
2-(furan-2-yl)-3-(4-methylpyridin-2-yl)quinazolin-4(3H)-one
CID 645426
2-(furan-2-yl)-3-(1-methyl-1H-benzimidazol-2-yl)quinazolin-4(3H)-one
CID 659799
2-(Furan-2-yl)-3-pyridin-3-ylquinazolin-4-one
CID 823064
2-(furan-2-yl)-3-(pyridin-2-yl)quinazolin-4(3H)-one
CID 829486
2-(furan-2-yl)-3-(3-methylpyridin-2-yl)quinazolin-4(3H)-one
CID 829489
2-(2-furyl)-3-(1,3-thiazol-2-yl)-4(3H)-quinazolinone
CID 829492
N1-(3-(1H-imidazol-1-yl)propyl)-N2-(2-(furan-2-yl)-2-(4-phenylpiperazin-1-yl)ethyl)oxalamide
CID 16194953

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one?
The IUPAC name of 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one (CID 663919) is 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one.
What is the SMILES notation for 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one?
The canonical SMILES for 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one is O=c1c2ccccc2nc(-c2ccco2)n1CCCn1ccnc1.
What is the InChIKey of 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one?
The InChIKey is SMRWPOHCHCSTFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c23-18-14-5-1-2-6-15(14)20-17(16-7-3-12-24-16)22(18)10-4-9-21-11-8-19-13-21/h1-3,5-8,11-13H,4,9-10H2.
What are the key properties of 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one?
2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one has a molecular weight of 320.35 g/mol, XLogP of 2.94, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-3-(3-imidazol-1-ylpropyl)quinazolin-4-one is sourced from PubChem (CID 663919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).