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2,3-Dihydroindol-1-yl-[5-[(4-iodophenoxy)methyl]furan-2-yl]methanone

HCID 178656374
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Basic information

CAS
444936-00-9
Standard SMILES
O=C(c1ccc(COc2ccc(I)cc2)o1)N1CCc2ccccc21
InChIKey
NARMTRYGNKFSNQ-UHFFFAOYSA-N
Molecular formula
C20H16INO3
Average molar mass
445.2 g/mol
Monoisotopic mass
445.01749

Names & identifiers

Preferred name
2,3-Dihydroindol-1-yl-[5-[(4-iodophenoxy)methyl]furan-2-yl]methanone
IUPAC
2,3-dihydroindol-1-yl-[5-[(4-iodophenoxy)methyl]furan-2-yl]methanone
English name
1-{5-[(4-iodophenoxy)methyl]-2-furoyl}indoline
Molecular formula
C20H16INO3
Molecular weight
445.25041

Names & synonyms

2,3-dihydroindol-1-yl-[5-[(4-iodophenoxy)methyl]furan-2-yl]methanone1-{5-[(4-iodophenoxy)methyl]-2-furoyl}indolineAK-968/15608620STL174559AKOS003794607ST45163934indolinyl 5-[(4-iodophenoxy)methyl](2-furyl) ketone2,3-dihydro-1H-indol-1-yl{5-[(4-iodophenoxy)methyl]furan-2-yl}methanone(2,3-dihydro-1H-indol-1-yl){5-[(4-iodophenoxy)methyl]furan-2-yl}methanone444936-00-9

Database identifiers

CAS
444936-00-9
PubChem CID
1017781

Properties

Computed structural propertiesFilling in

XLogP
4.5
Topological polar surface area
42.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
466

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