4(3H)-Quinazolinone, 3-(p-(2-benzimidazolyl)phenyl)-6,8-dibromo-2-methyl-

HCID 63168

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Basic information

CAS: 76618-12-7
Standard SMILES: Cc1nc2c(Br)cc(Br)cc2c(=O)n1-c1ccc(-c2nc3ccccc3[nH]2)cc1
InChIKey: ZAIRXOYJBQNJBR-UHFFFAOYSA-N
Molecular formula: C22H14Br2N4O
Average molar mass: 510.2 g/mol
Monoisotopic mass: 507.95344

Names & identifiers

Preferred name: 4(3H)-Quinazolinone, 3-(p-(2-benzimidazolyl)phenyl)-6,8-dibromo-2-methyl-
IUPAC: 3-[4-(1H-benzimidazol-2-yl)phenyl]-6,8-dibromo-2-methylquinazolin-4-one

Names & synonyms

BRN 56431984(3H)-Quinazolinone, 3-(p-(2-benzimidazolyl)phenyl)-6,8-dibromo-2-methyl-76618-12-7DTXSID302274453-(p-(2-Benzimidazolyl)phenyl)-6,8-dibromo-2-methyl-4(3H)-quinazolinoneRefChem:284152DTXCID301499363-[4-(1H-1,3-Benzimidazol-2-yl)phenyl]-6,8-dibromo-2-methylquinazolin-4(3H)-one

Database identifiers

CAS: 76618-12-7
PubChem CID: 63168
DTXSID: DTXSID30227445
Nikkaji: J73.038F

Properties

Computed structural properties

XLogP: 5
Topological polar surface area: 61.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 29
Formal charge: 0
Complexity: 665

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