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306935-13-7 | 2-Thiophenecarboxamide, 3-amino-5-[4-(1,1-dimethylethyl)phenyl]-
CAS No: 306935-13-7 Catalog No: AG0030V3 MDL No:MFCD02179918
Product Description
Catalog Number:
AG0030V3
Chemical Name:
2-Thiophenecarboxamide, 3-amino-5-[4-(1,1-dimethylethyl)phenyl]-
CAS Number:
306935-13-7
Molecular Formula:
C15H18N2OS
Molecular Weight:
274.3812
MDL Number:
MFCD02179918
IUPAC Name:
3-amino-5-(4-tert-butylphenyl)thiophene-2-carboxamide
InChI:
InChI=1S/C15H18N2OS/c1-15(2,3)10-6-4-9(5-7-10)12-8-11(16)13(19-12)14(17)18/h4-8H,16H2,1-3H3,(H2,17,18)
InChI Key:
OGIKEMGUAQEZJE-UHFFFAOYSA-N
SMILES:
NC(=O)c1sc(cc1N)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.114g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
274.382g/mol
Monoisotopic Mass:
274.114g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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