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2,4-dichloro-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]benzamide

HCID 178657129
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Basic information

CAS
324019-49-0
Standard SMILES
O=C(Nc1ccc2oc(-c3cccc(I)c3)nc2c1)c1ccc(Cl)cc1Cl
InChIKey
SSYUEJLIOUBTAJ-UHFFFAOYSA-N
Molecular formula
C20H11Cl2IN2O2
Average molar mass
509.1 g/mol
Monoisotopic mass
507.92423

Names & identifiers

Preferred name
2,4-dichloro-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]benzamide
IUPAC
2,4-dichloro-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]benzamide
English name
2,4-dichloro-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]benzamide
Molecular formula
C20H11Cl2IN2O2
Molecular weight
509.12401

Names & synonyms

2,4-dichloro-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]benzamideOprea1_689465Oprea1_786580STK029629AKOS000514675ST50332495AG-690/40112017SR-01000399739SR-01000399739-1(2,4-dichlorophenyl)-N-[2-(3-iodophenyl)benzoxazol-5-yl]carboxamide324019-49-0

Database identifiers

CAS
324019-49-0
PubChem CID
1626901

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
55.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
27
Formal charge
0
Complexity
540

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