4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)-

HCID 63283

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Basic information

CAS: 75057-66-8
Standard SMILES: COc1ccccc1OCc1nc2cc(I)ccc2c(=O)n1-c1ccccn1
InChIKey: KZDXISZRSWHTIW-UHFFFAOYSA-N
Molecular formula: C21H16IN3O3
Average molar mass: 485.3 g/mol
Monoisotopic mass: 485.02364

Names & identifiers

Preferred name: 4(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)-
IUPAC: 7-iodo-2-[(2-methoxyphenoxy)methyl]-3-pyridin-2-ylquinazolin-4-one

Names & synonyms

BRN 07189884(3H)-Quinazolinone, 7-iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)-75057-66-87-Iodo-2-((o-methoxyphenoxy)methyl)-3-(2-pyridyl)-4(3H)-quinazolinoneDTXSID202260287-Iodo-2-[(2-methoxyphenoxy)methyl]-3-(pyridin-2-yl)quinazolin-4(3H)-one

Database identifiers

CAS: 75057-66-8
PubChem CID: 63283
DTXSID: DTXSID20226028

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 64 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 28
Formal charge: 0
Complexity: 587

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