2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one

C23H20N4O2 — CID 6070250

IUPAC2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one
SMILESCOc1ccccc1/C(C)=N\Nc1nc2ccccc2c(=O)n1-c1ccccc1
InChIInChI=1S/C23H20N4O2/c1-16(18-12-7-9-15-21(18)29-2)25-26-23-24-20-14-8-6-13-19(20)22(28)27(23)17-10-4-3-5-11-17/h3-15H,1-2H3,(H,24,26)/b25-16-
InChIKeyPBUDZWHYMYYTFY-XYGWBWBKSA-N
MW384.44 g/mol
LogP4.23
Rot. Bonds5

About 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one

2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one (PubChem CID 6070250) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one.

Molecular Properties

Compound Name2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one
PubChem CID6070250
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one
SMILESCOc1ccccc1/C(C)=N\Nc1nc2ccccc2c(=O)n1-c1ccccc1
InChIInChI=1S/C23H20N4O2/c1-16(18-12-7-9-15-21(18)29-2)25-26-23-24-20-14-8-6-13-19(20)22(28)27(23)17-10-4-3-5-11-17/h3-15H,1-2H3,(H,24,26)/b25-16-
InChIKeyPBUDZWHYMYYTFY-XYGWBWBKSA-N
XLogP4.23
TPSA68.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(2Z)-2-[(2,5-dimethoxyphenyl)methylidene]hydrazinyl]-3-phenylquinazolin-4-one
CID 6511521
2-[(2Z)-2-[1-(2-methoxy-5-methylphenyl)ethylidene]hydrazinyl]-3-(3-methoxypropyl)quinazolin-4-one
CID 9299851
N-[(E)-1-(2-methoxyphenyl)ethylideneamino]aniline
CID 15349196
2-[(2Z)-2-[(2-methylphenyl)methylidene]hydrazinyl]-3-phenylquinazolin-4-one
CID 6513719
3-(2,4-dimethylphenyl)-2-[(2Z)-2-(1-phenylethylidene)hydrazinyl]quinazolin-4-one
CID 8984212
3-phenyl-2-(propan-2-ylamino)quinazolin-4-one
CID 11011362
2-[2-(2-hydroxy-3-methoxyphenyl)ethenyl]-3-phenylquinazolin-4-one
CID 2862994
3-hydroxy-2-[2-(1-phenylethylidene)hydrazinyl]quinazolin-4-one
CID 4888440
3-phenyl-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]quinazolin-4-one
CID 6074627
N-[1-(2-hydroxyphenyl)ethylideneamino]-2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 1400610
2-[2-[(3,4-dichlorophenyl)methylidene]hydrazinyl]-3-phenylquinazolin-4-one
CID 3640022
2-[(2E)-2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl]-3-phenylquinazolin-4-one
CID 135822277

Frequently Asked Questions

What is the IUPAC name of 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one?
The IUPAC name of 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one (CID 6070250) is 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one.
What is the SMILES notation for 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one?
The canonical SMILES for 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one is COc1ccccc1/C(C)=N\Nc1nc2ccccc2c(=O)n1-c1ccccc1.
What is the InChIKey of 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one?
The InChIKey is PBUDZWHYMYYTFY-XYGWBWBKSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-16(18-12-7-9-15-21(18)29-2)25-26-23-24-20-14-8-6-13-19(20)22(28)27(23)17-10-4-3-5-11-17/h3-15H,1-2H3,(H,24,26)/b25-16-.
What are the key properties of 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one?
2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one has a molecular weight of 384.44 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2Z)-2-[1-(2-methoxyphenyl)ethylidene]hydrazinyl]-3-phenylquinazolin-4-one is sourced from PubChem (CID 6070250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).