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Home > Pyridines > 1193387-78-8
1193387-78-8 | 4,6-dimethyl-2-(pyrrolidin-1-yl)pyridine-3-carbothioamide
CAS No: 1193387-78-8 Catalog No: AG019R2B MDL No:MFCD12913263
Product Description
Catalog Number:
AG019R2B
Chemical Name:
4,6-dimethyl-2-(pyrrolidin-1-yl)pyridine-3-carbothioamide
CAS Number:
1193387-78-8
Molecular Formula:
C12H17N3S
Molecular Weight:
235.3485
MDL Number:
MFCD12913263
IUPAC Name:
4,6-dimethyl-2-pyrrolidin-1-ylpyridine-3-carbothioamide
InChI:
InChI=1S/C12H17N3S/c1-8-7-9(2)14-12(10(8)11(13)16)15-5-3-4-6-15/h7H,3-6H2,1-2H3,(H2,13,16)
InChI Key:
SKXNMPZGEUOKFN-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(n1)N1CCCC1)C(=S)N
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.114g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.349g/mol
Monoisotopic Mass:
235.114g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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