4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol

C17H15N3O2 — CID 143413846

IUPAC4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol
SMILESCOc1cc2c(N3Cc4ccccc4C3)ncnc2cc1O
InChIInChI=1S/C17H15N3O2/c1-22-16-6-13-14(7-15(16)21)18-10-19-17(13)20-8-11-4-2-3-5-12(11)9-20/h2-7,10,21H,8-9H2,1H3
InChIKeyJFTDGOJKGPTZGZ-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.86
Rot. Bonds2

About 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol

4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol (PubChem CID 143413846) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol.

Molecular Properties

Compound Name4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol
PubChem CID143413846
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol
SMILESCOc1cc2c(N3Cc4ccccc4C3)ncnc2cc1O
InChIInChI=1S/C17H15N3O2/c1-22-16-6-13-14(7-15(16)21)18-10-19-17(13)20-8-11-4-2-3-5-12(11)9-20/h2-7,10,21H,8-9H2,1H3
InChIKeyJFTDGOJKGPTZGZ-UHFFFAOYSA-N
XLogP2.86
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol 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

4-(3,4-dihydro-1H-isoquinolin-2-yl)-6,7-dimethoxyquinazoline
CID 21002947
4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-ethoxy-7-methoxyquinazoline
CID 11537337
4-(1,3-dimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl)-6-methoxyquinazolin-7-ol;methane
CID 158708071
acetic acid;2-(6,7-dimethoxyquinazolin-4-yl)-3,4-dihydro-1H-isoquinoline-6-carboxylic acid
CID 143413817
6,7-dimethoxy-4-(4-methylpiperazin-1-yl)quinazoline
CID 2808928
lithium;1-(6,7-dimethoxyquinazolin-4-yl)-2,3-dihydroindole-2-carboxylic acid;hydride
CID 173315528
1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-one
CID 14738823
4-amino-6-methoxyquinazolin-7-ol
CID 135697903
[4-(6,7-dimethoxyquinazolin-4-yl)piperazin-1-yl]methylidenevanadium
CID 22954242
4-(6-methoxy-7-phenylmethoxyquinazolin-4-yl)piperazine-1-carboxylic acid
CID 22707591
4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxamide
CID 86756553
2-[4-(6,7-dimethoxyquinazolin-4-yl)piperazin-1-yl]-N-pyridin-3-ylpyrimidin-5-amine;ethane;6-methoxy-4-[4-[5-(pyridin-4-ylamino)pyrimidin-2-yl]piperazin-1-yl]quinazolin-7-ol
CID 144729057

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol?
The IUPAC name of 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol (CID 143413846) is 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol.
What is the SMILES notation for 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol?
The canonical SMILES for 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol is COc1cc2c(N3Cc4ccccc4C3)ncnc2cc1O.
What is the InChIKey of 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol?
The InChIKey is JFTDGOJKGPTZGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-22-16-6-13-14(7-15(16)21)18-10-19-17(13)20-8-11-4-2-3-5-12(11)9-20/h2-7,10,21H,8-9H2,1H3.
What are the key properties of 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol?
4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol has a molecular weight of 293.33 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-dihydroisoindol-2-yl)-6-methoxyquinazolin-7-ol is sourced from PubChem (CID 143413846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).