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Home > Indoles and Oxindole > 1504793-34-3
1504793-34-3 | 2-[2-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione
CAS No: 1504793-34-3 Catalog No: AG01B1KV MDL No:MFCD27960338
Product Description
Catalog Number:
AG01B1KV
Chemical Name:
2-[2-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione
CAS Number:
1504793-34-3
Molecular Formula:
C13H10N2O3S
Molecular Weight:
274.2951
MDL Number:
MFCD27960338
IUPAC Name:
2-[2-(2-oxo-3H-1,3-thiazol-4-yl)ethyl]isoindole-1,3-dione
InChI:
InChI=1S/C13H10N2O3S/c16-11-9-3-1-2-4-10(9)12(17)15(11)6-5-8-7-19-13(18)14-8/h1-4,7H,5-6H2,(H,14,18)
InChI Key:
OFFFXMDNUGXBMN-UHFFFAOYSA-N
SMILES:
O=C1N(CCc2csc(=O)[nH]2)C(=O)c2c1cccc2
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.041g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.294g/mol
Monoisotopic Mass:
274.041g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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