N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide

C16H12ClN3O3 — CID 4973865

IUPACN-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide
SMILESO=C(Cn1c(=O)[nH]c2ccccc2c1=O)Nc1cccc(Cl)c1
InChIInChI=1S/C16H12ClN3O3/c17-10-4-3-5-11(8-10)18-14(21)9-20-15(22)12-6-1-2-7-13(12)19-16(20)23/h1-8H,9H2,(H,18,21)(H,19,23)
InChIKeyBHLYREOUHNMSOT-UHFFFAOYSA-N
MW329.74 g/mol
LogP1.98
Rot. Bonds3

About N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide

N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide (PubChem CID 4973865) has the molecular formula C16H12ClN3O3 and a molecular weight of 329.74 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide
PubChem CID4973865
Molecular FormulaC16H12ClN3O3
Molecular Weight329.74 g/mol
Exact Mass329.06
IUPAC NameN-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide
SMILESO=C(Cn1c(=O)[nH]c2ccccc2c1=O)Nc1cccc(Cl)c1
InChIInChI=1S/C16H12ClN3O3/c17-10-4-3-5-11(8-10)18-14(21)9-20-15(22)12-6-1-2-7-13(12)19-16(20)23/h1-8H,9H2,(H,18,21)(H,19,23)
InChIKeyBHLYREOUHNMSOT-UHFFFAOYSA-N
XLogP1.98
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.74
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide 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

N-(3-chlorophenyl)-3-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
CID 4973826
N-(3,5-dichlorophenyl)-3-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
CID 4904089
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-pyridin-3-ylacetamide
CID 4906968
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(4-phenoxyphenyl)acetamide
CID 4975182
N-(3-chlorophenyl)-2-(9-oxoacridin-10-yl)acetamide
CID 15991917
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(2-oxochromen-6-yl)acetamide
CID 42506993
N-[3-[[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]amino]-4-methylphenyl]propanamide
CID 55725404
N-(3-chlorophenyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide
CID 9412227
N-(4-chlorophenyl)-4-(2,4-dioxo-1H-quinazolin-3-yl)butanamide
CID 4302111
N-[4-(dimethylsulfamoyl)phenyl]-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide
CID 55600769
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(1-hydroxy-3-phenylpropan-2-yl)acetamide
CID 91636848
2-(3-chloro-9-oxoacridin-10-yl)-N-(3-chlorophenyl)acetamide
CID 22330394

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide (CID 4973865) is N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide is O=C(Cn1c(=O)[nH]c2ccccc2c1=O)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide?
The InChIKey is BHLYREOUHNMSOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClN3O3/c17-10-4-3-5-11(8-10)18-14(21)9-20-15(22)12-6-1-2-7-13(12)19-16(20)23/h1-8H,9H2,(H,18,21)(H,19,23).
What are the key properties of N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide?
N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide has a molecular weight of 329.74 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide is sourced from PubChem (CID 4973865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).