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140-19-2 | 2-Pyridinamine, N-(2-thienylmethyl)-
CAS No: 140-19-2 Catalog No: AG001BWW MDL No:MFCD03826740
Product Description
Catalog Number:
AG001BWW
Chemical Name:
2-Pyridinamine, N-(2-thienylmethyl)-
CAS Number:
140-19-2
Molecular Formula:
C10H10N2S
Molecular Weight:
190.2648
MDL Number:
MFCD03826740
IUPAC Name:
N-(thiophen-2-ylmethyl)pyridin-2-amine
InChI:
InChI=1S/C10H10N2S/c1-2-6-11-10(5-1)12-8-9-4-3-7-13-9/h1-7H,8H2,(H,11,12)
InChI Key:
SQJPDAQZMOQYLY-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)NCc1cccs1
EC Number:
205-401-6
UNII:
IZ4NZM5O6S
NSC Number:
30207
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.264g/mol
Monoisotopic Mass:
190.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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