200,000+ products from a single source!
sales@angenechem.com
203436-48-0 | Benzenemethanamine, 4-(2-thienyl)-
CAS No: 203436-48-0 Catalog No: AG0028W0 MDL No:MFCD02682030
Product Description
Catalog Number:
AG0028W0
Chemical Name:
Benzenemethanamine, 4-(2-thienyl)-
CAS Number:
203436-48-0
Molecular Formula:
C11H11NS
Molecular Weight:
189.2767
MDL Number:
MFCD02682030
IUPAC Name:
(4-thiophen-2-ylphenyl)methanamine
InChI:
InChI=1S/C11H11NS/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7H,8,12H2
InChI Key:
YKNLMMDEWQZCLJ-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)c1cccs1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.061g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.276g/mol
Monoisotopic Mass:
189.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Discovery of 4-[(2S)-2-{[4-(4-chlorophenoxy)phenoxy]methyl}-1-pyrrolidinyl]butanoic acid (DG-051) as a novel leukotriene A4 hydrolase inhibitor of leukotriene B4 biosynthesis. | Journal of medicinal chemistry 20100128 |
| Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography. | Journal of medicinal chemistry 20090813 |
Related Products
© 2019 Angene International Limited. All rights Reserved.