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Home > Thiazole > 1170301-38-8
1170301-38-8 | 2-(1-methyl-1H-pyrazol-4-yl)-1,3-benzothiazole
CAS No: 1170301-38-8 Catalog No: AG01AIG4 MDL No:MFCD11818396
Product Description
Catalog Number:
AG01AIG4
Chemical Name:
2-(1-methyl-1H-pyrazol-4-yl)-1,3-benzothiazole
CAS Number:
1170301-38-8
Molecular Formula:
C11H9N3S
Molecular Weight:
215.2743
MDL Number:
MFCD11818396
IUPAC Name:
2-(1-methylpyrazol-4-yl)-1,3-benzothiazole
InChI:
InChI=1S/C11H9N3S/c1-14-7-8(6-12-14)11-13-9-4-2-3-5-10(9)15-11/h2-7H,1H3
InChI Key:
METLFGMLNIBQBP-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1)c1nc2c(s1)cccc2
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.052g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.274g/mol
Monoisotopic Mass:
215.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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