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Home > Indoles and Oxindole > 1803571-75-6
1803571-75-6 | 2-{[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione
CAS No: 1803571-75-6 Catalog No: AG01AC7C MDL No:MFCD26407906
Product Description
Catalog Number:
AG01AC7C
Chemical Name:
2-{[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione
CAS Number:
1803571-75-6
Molecular Formula:
C20H12N2O3S
Molecular Weight:
360.3859
MDL Number:
MFCD26407906
IUPAC Name:
2-[[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]methyl]isoindole-1,3-dione
InChI:
InChI=1S/C20H12N2O3S/c23-19-13-6-2-3-7-14(13)20(24)22(19)10-18-21-15(11-26-18)17-9-12-5-1-4-8-16(12)25-17/h1-9,11H,10H2
InChI Key:
FTEJLSHKHVGYRY-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2scc(n2)c2cc3c(o2)cccc3)C(=O)c2c1cccc2
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.057g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.387g/mol
Monoisotopic Mass:
360.057g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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