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1286709-71-4 | 3-(2-Methoxyethyl)-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-imine
CAS No: 1286709-71-4 Catalog No: AG01FMZA MDL No:MFCD22587804
Product Description
Catalog Number:
AG01FMZA
Chemical Name:
3-(2-Methoxyethyl)-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-imine
CAS Number:
1286709-71-4
Molecular Formula:
C11H14N2O3S2
Molecular Weight:
286.3705
MDL Number:
MFCD22587804
IUPAC Name:
3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-imine
InChI:
InChI=1S/C11H14N2O3S2/c1-16-6-5-13-9-4-3-8(18(2,14)15)7-10(9)17-11(13)12/h3-4,7,12H,5-6H2,1-2H3
InChI Key:
MYQLJLOYEGCQKF-UHFFFAOYSA-N
SMILES:
COCCn1c(=N)sc2c1ccc(c2)S(=O)(=O)C
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.045g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.364g/mol
Monoisotopic Mass:
286.045g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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