BRN 5652730

3-[4-(1H-benzimidazol-2-yl)phenyl]-6-iodo-2-phenylquinazolin-4-one

CAS: 76618-07-0

Molecular Formula	`C27H17IN4O`
Molecular Weight	540.4 g/mol
LogP	6.0
Topological Polar Surface Area	61.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	540.04474
Heavy Atoms	33
Complexity	744.0

Chemical Identifiers

CAS Number	76618-07-0
SMILES	`C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)C5=NC6=CC=CC=C6N5`
InChIKey	`LWKYFHJBKIOKIR-UHFFFAOYSA-N`

📖 Product Overview

BRN 5652730 (CAS: 76618-07-0) is a chemical compound with molecular formula C27H17IN4O and molecular weight 540.4 g/mol. Its IUPAC systematic name is 3-[4-(1H-benzimidazol-2-yl)phenyl]-6-iodo-2-phenylquinazolin-4-one. LogP 6.0 Topological Polar Surface Area 61.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 540.04474 Heavy Atoms 33 Complexity 744.0 InChI Key: LWKYFHJBKIOKIR-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)C5=NC6=CC=CC=C6N5.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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