4(3H)-Quinazolinone, 3-(2,4-dimethylphenyl)-6-iodo-2-methyl-

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Basic information

CAS: 35711-12-7
Standard SMILES: Cc1ccc(-n2c(C)nc3ccc(I)cc3c2=O)c(C)c1
InChIKey: RLIYGZRMLCTDBL-UHFFFAOYSA-N
Molecular formula: C17H15IN2O
Average molar mass: 390.22 g/mol
Monoisotopic mass: 390.02291

Names & identifiers

Preferred name: 4(3H)-Quinazolinone, 3-(2,4-dimethylphenyl)-6-iodo-2-methyl-
IUPAC: 3-(2,4-dimethylphenyl)-6-iodo-2-methylquinazolin-4-one

Names & synonyms

4(3H)-Quinazolinone, 3-(2,4-dimethylphenyl)-6-iodo-2-methyl-35711-12-73-(2,4-Dimethylphenyl)-6-iodo-2-methyl-4(3H)-quinazolinoneDTXSID50189233RefChem:283966DTXCID801117243-(2,4-dimethylphenyl)-6-iodo-2-methylquinazolin-4(3H)-oneSTK558150AKOS005483941

Database identifiers

CAS: 35711-12-7
PubChem CID: 63445
DTXSID: DTXSID50189233

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 32.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 21
Formal charge: 0
Complexity: 450

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Compound notes

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