200,000+ products from a single source!
sales@angenechem.com
175277-75-5 | Thieno[2,3-b]pyridine-2,5-dicarboxylic acid, 3-amino-6-(trifluoromethyl)-, 2,5-diethyl ester
CAS No: 175277-75-5 Catalog No: AG0020T5 MDL No:MFCD00221307
Product Description
Catalog Number:
AG0020T5
Chemical Name:
Thieno[2,3-b]pyridine-2,5-dicarboxylic acid, 3-amino-6-(trifluoromethyl)-, 2,5-diethyl ester
CAS Number:
175277-75-5
Molecular Formula:
C14H13F3N2O4S
Molecular Weight:
362.3242
MDL Number:
MFCD00221307
IUPAC Name:
diethyl 3-amino-6-(trifluoromethyl)thieno[2,3-b]pyridine-2,5-dicarboxylate
InChI:
InChI=1S/C14H13F3N2O4S/c1-3-22-12(20)7-5-6-8(18)9(13(21)23-4-2)24-11(6)19-10(7)14(15,16)17/h5H,3-4,18H2,1-2H3
InChI Key:
YVHYPZIKTPMTKQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c(nc1C(F)(F)F)sc(c2N)C(=O)OCC
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.055g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
362.323g/mol
Monoisotopic Mass:
362.055g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.