5-Chloro-2-{4-[2-(2-phenyl-1,3-benzoxazol-6-yl)ethenyl]phenyl}-1,3-benzoxazole

HCID 54375072

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Basic information

CAS: 67563-47-7
Standard SMILES: Clc1ccc2oc(-c3ccc(C=Cc4ccc5nc(-c6ccccc6)oc5c4)cc3)nc2c1
InChIKey: UVXLRZVJNPFWAW-UHFFFAOYSA-N
Molecular formula: C28H17ClN2O2
Average molar mass: 448.9 g/mol
Monoisotopic mass: 448.0978555

Names & identifiers

Preferred name: 5-Chloro-2-{4-[2-(2-phenyl-1,3-benzoxazol-6-yl)ethenyl]phenyl}-1,3-benzoxazole
IUPAC: 5-chloro-2-[4-[2-(2-phenyl-1,3-benzoxazol-6-yl)ethenyl]phenyl]-1,3-benzoxazole

Names & synonyms

67563-47-7SCHEMBL11563569DTXSID10710926UVXLRZVJNPFWAW-UHFFFAOYSA-N5-Chloro-2-{4-[2-(2-phenyl-1,3-benzoxazol-6-yl)ethenyl]phenyl}-1,3-benzoxazole1-(2-phenylbenzoxazol-6-yl)-2-[4'-(5-chlorbenzoxazol-2-yl)-phenyl]-ethylene5-Chloro-2-{4-[2-(2-phenyl-1,3-benzoxazol-6-yl)ethen-1-yl]phenyl}-1,3-benzoxazole

Database identifiers

CAS: 67563-47-7
PubChem CID: 54375072
DTXSID: DTXSID10710926

Properties

Computed structural properties

XLogP: 7.8
Topological polar surface area: 52.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 4
Heavy atoms: 33
Formal charge: 0
Complexity: 675

Related reactions

1 records

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HRID 1863070As productuspto-grants-1979_09

Compound notes

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