200,000+ products from a single source!
sales@angenechem.com
175276-56-9 | 3-Thiophenamine, 4-[(1-methylethyl)sulfonyl]-5-(methylthio)-
CAS No: 175276-56-9 Catalog No: AG0020QM MDL No:MFCD00221066
Product Description
Catalog Number:
AG0020QM
Chemical Name:
3-Thiophenamine, 4-[(1-methylethyl)sulfonyl]-5-(methylthio)-
CAS Number:
175276-56-9
Molecular Formula:
C8H13NO2S3
Molecular Weight:
251.3893
MDL Number:
MFCD00221066
IUPAC Name:
5-methylsulfanyl-4-propan-2-ylsulfonylthiophen-3-amine
InChI:
InChI=1S/C8H13NO2S3/c1-5(2)14(10,11)7-6(9)4-13-8(7)12-3/h4-5H,9H2,1-3H3
InChI Key:
KREUICQMPFEDBA-UHFFFAOYSA-N
SMILES:
CSc1scc(c1S(=O)(=O)C(C)C)N
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.011g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.377g/mol
Monoisotopic Mass:
251.011g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
122A^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 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.