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Home > Indoles and Oxindole > 1193387-34-6
1193387-34-6 | 2,3-dimethyl-1H-indole-5-carbothioamide
CAS No: 1193387-34-6 Catalog No: AG019R1Q MDL No:MFCD12913246
Product Description
Catalog Number:
AG019R1Q
Chemical Name:
2,3-dimethyl-1H-indole-5-carbothioamide
CAS Number:
1193387-34-6
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
MDL Number:
MFCD12913246
IUPAC Name:
2,3-dimethyl-1H-indole-5-carbothioamide
InChI:
InChI=1S/C11H12N2S/c1-6-7(2)13-10-4-3-8(11(12)14)5-9(6)10/h3-5,13H,1-2H3,(H2,12,14)
InChI Key:
IZPVZTKQYGFGLH-UHFFFAOYSA-N
SMILES:
NC(=S)c1ccc2c(c1)c(C)c([nH]2)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.291g/mol
Monoisotopic Mass:
204.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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