6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one

C14H10BrClN4O — CID 13357174

IUPAC6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one
SMILESNNc1nc2ccc(Br)cc2c(=O)n1-c1ccccc1Cl
InChIInChI=1S/C14H10BrClN4O/c15-8-5-6-11-9(7-8)13(21)20(14(18-11)19-17)12-4-2-1-3-10(12)16/h1-7H,17H2,(H,18,19)
InChIKeyOQPYKOVQAJUJBQ-UHFFFAOYSA-N
MW365.62 g/mol
LogP3.09
Rot. Bonds2

About 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one

6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one (PubChem CID 13357174) has the molecular formula C14H10BrClN4O and a molecular weight of 365.62 g/mol. Its IUPAC name is 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one.

Molecular Properties

Compound Name6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one
PubChem CID13357174
Molecular FormulaC14H10BrClN4O
Molecular Weight365.62 g/mol
Exact Mass363.97
IUPAC Name6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one
SMILESNNc1nc2ccc(Br)cc2c(=O)n1-c1ccccc1Cl
InChIInChI=1S/C14H10BrClN4O/c15-8-5-6-11-9(7-8)13(21)20(14(18-11)19-17)12-4-2-1-3-10(12)16/h1-7H,17H2,(H,18,19)
InChIKeyOQPYKOVQAJUJBQ-UHFFFAOYSA-N
XLogP3.09
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.62
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-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

3-(3-bromophenyl)-2-hydrazinylquinazolin-4-one
CID 15562170
6,8-dibromo-2-hydrazinyl-3-phenylquinazolin-4-one
CID 12845265
2-[2-(5-bromo-2-hydroxyphenyl)ethenyl]-3-(2-chlorophenyl)-6-iodoquinazolin-4-one
CID 4872854
6-bromo-3-(3-chlorophenyl)-2-(hydrazinylmethyl)quinazolin-4-one
CID 11014381
2-hydrazinyl-6,7-dimethoxy-3-(2-methoxyphenyl)quinazolin-4-one
CID 17221406
7-bromo-3-(2-chlorophenyl)-2-sulfanylidene-1H-quinazolin-4-one
CID 177325807
2-[(5-bromo-2-oxo-1H-indol-3-ylidene)methyl]-3-(2-chlorophenyl)quinazolin-4-one
CID 2921515
3-amino-6-bromo-2-(4-bromoanilino)quinazolin-4-one
CID 13241183
3-benzyl-6-chloro-2-hydrazinylquinazolin-4-one
CID 22609425
6-bromo-3-(2-fluorophenyl)-2-propylquinazolin-4-one
CID 1302543
3-(4-aminophenyl)-8-bromo-1-(2-chlorophenyl)imidazo[4,5-c]quinolin-2-one
CID 67256236
7-bromo-2-(2-chlorophenyl)-3-phenylquinazolin-4-one
CID 155671998

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one?
The IUPAC name of 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one (CID 13357174) is 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one.
What is the SMILES notation for 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one?
The canonical SMILES for 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one is NNc1nc2ccc(Br)cc2c(=O)n1-c1ccccc1Cl.
What is the InChIKey of 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one?
The InChIKey is OQPYKOVQAJUJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClN4O/c15-8-5-6-11-9(7-8)13(21)20(14(18-11)19-17)12-4-2-1-3-10(12)16/h1-7H,17H2,(H,18,19).
What are the key properties of 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one?
6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one has a molecular weight of 365.62 g/mol, XLogP of 3.09, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(2-chlorophenyl)-2-hydrazinylquinazolin-4-one is sourced from PubChem (CID 13357174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).