3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one

C24H24N2O3 — CID 54780311

IUPAC3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one
SMILESCOCCN1C(=O)c2ccccc2NC1c1ccccc1OCc1ccccc1
InChIInChI=1S/C24H24N2O3/c1-28-16-15-26-23(25-21-13-7-5-11-19(21)24(26)27)20-12-6-8-14-22(20)29-17-18-9-3-2-4-10-18/h2-14,23,25H,15-17H2,1H3
InChIKeyCGYRLNGTVLNMIY-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.48
Rot. Bonds7

About 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one

3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one (PubChem CID 54780311) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one.

Molecular Properties

Compound Name3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one
PubChem CID54780311
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one
SMILESCOCCN1C(=O)c2ccccc2NC1c1ccccc1OCc1ccccc1
InChIInChI=1S/C24H24N2O3/c1-28-16-15-26-23(25-21-13-7-5-11-19(21)24(26)27)20-12-6-8-14-22(20)29-17-18-9-3-2-4-10-18/h2-14,23,25H,15-17H2,1H3
InChIKeyCGYRLNGTVLNMIY-UHFFFAOYSA-N
XLogP4.48
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-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

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one?
The IUPAC name of 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one (CID 54780311) is 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one.
What is the SMILES notation for 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one?
The canonical SMILES for 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one is COCCN1C(=O)c2ccccc2NC1c1ccccc1OCc1ccccc1.
What is the InChIKey of 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one?
The InChIKey is CGYRLNGTVLNMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-28-16-15-26-23(25-21-13-7-5-11-19(21)24(26)27)20-12-6-8-14-22(20)29-17-18-9-3-2-4-10-18/h2-14,23,25H,15-17H2,1H3.
What are the key properties of 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one?
3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one has a molecular weight of 388.47 g/mol, XLogP of 4.48, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-2-(2-phenylmethoxyphenyl)-1,2-dihydroquinazolin-4-one is sourced from PubChem (CID 54780311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).