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Home > Indoles and Oxindole > 1553985-64-0
1553985-64-0 | 2-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-4-sulfonyl chloride
CAS No: 1553985-64-0 Catalog No: AG01C4U7 MDL No:MFCD24284207
Product Description
Catalog Number:
AG01C4U7
Chemical Name:
2-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-4-sulfonyl chloride
CAS Number:
1553985-64-0
Molecular Formula:
C11H9ClN2O2S2
Molecular Weight:
300.7844
MDL Number:
MFCD24284207
IUPAC Name:
2-(1,3-thiazol-2-yl)-1,3-dihydroisoindole-4-sulfonyl chloride
InChI:
InChI=1S/C11H9ClN2O2S2/c12-18(15,16)10-3-1-2-8-6-14(7-9(8)10)11-13-4-5-17-11/h1-5H,6-7H2
InChI Key:
QBQHLYRRAMJMTE-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1cccc2c1CN(C2)c1nccs1
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.979g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.775g/mol
Monoisotopic Mass:
299.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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