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121952-97-4 | 2-Thiazolamine, 5-(phenylmethyl)-
CAS No: 121952-97-4 Catalog No: AG0016GN MDL No:MFCD00547831
Product Description
Catalog Number:
AG0016GN
Chemical Name:
2-Thiazolamine, 5-(phenylmethyl)-
CAS Number:
121952-97-4
Molecular Formula:
C10H10N2S
Molecular Weight:
190.2648
MDL Number:
MFCD00547831
IUPAC Name:
5-benzyl-1,3-thiazol-2-amine
InChI:
InChI=1S/C10H10N2S/c11-10-12-7-9(13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,11,12)
InChI Key:
FJIMLXBJUVLMMN-UHFFFAOYSA-N
SMILES:
Nc1ncc(s1)Cc1ccccc1
Properties
Complexity:
157
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:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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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