Compound C21H16IN3O2

6-iodo-2-[(4-methylphenyl)methoxy]-3-pyridin-2-ylquinazolin-4-one

CAS: 85178-77-4

Molecular Formula	`C21H16IN3O2`
Molecular Weight	469.3 g/mol
LogP	4.6
Topological Polar Surface Area	54.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	469.02872
Heavy Atoms	27
Complexity	562.0

Chemical Identifiers

CAS Number	85178-77-4
SMILES	`CC1=CC=C(C=C1)COC2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=CC=N4`
InChIKey	`WITVHZAQJYUXHX-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H16IN3O2 (CAS: 85178-77-4) is a chemical compound with molecular formula C21H16IN3O2 and molecular weight 469.3 g/mol. Its IUPAC systematic name is 6-iodo-2-[(4-methylphenyl)methoxy]-3-pyridin-2-ylquinazolin-4-one. LogP 4.6 Topological Polar Surface Area 54.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 469.02872 Heavy Atoms 27 Complexity 562.0 InChI Key: WITVHZAQJYUXHX-UHFFFAOYSA-N. SMILES: CC1=CC=C(C=C1)COC2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=CC=N4.

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