200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1462950-10-2
1462950-10-2 | Thieno[3,2-d]pyrimidine-6-carboxylic acid, 7-(5-fluoro-2-methoxyphenyl)-2-(methylsulfonyl)-, methyl ester
CAS No: 1462950-10-2 Catalog No: AG001DUK MDL No:
Product Description
Catalog Number:
AG001DUK
Chemical Name:
Thieno[3,2-d]pyrimidine-6-carboxylic acid, 7-(5-fluoro-2-methoxyphenyl)-2-(methylsulfonyl)-, methyl ester
CAS Number:
1462950-10-2
Molecular Formula:
C16H13FN2O5S2
Molecular Weight:
396.4132
IUPAC Name:
methyl 7-(5-fluoro-2-methoxyphenyl)-2-methylsulfonylthieno[3,2-d]pyrimidine-6-carboxylate
InChI:
InChI=1S/C16H13FN2O5S2/c1-23-10-5-4-8(17)6-9(10)12-13-11(25-14(12)15(20)24-2)7-18-16(19-13)26(3,21)22/h4-7H,1-3H3
InChI Key:
QPNGNXMMUXZFPC-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc2c(c1c1cc(F)ccc1OC)nc(nc2)S(=O)(=O)C
Properties
Complexity:
629
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.025g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.407g/mol
Monoisotopic Mass:
396.025g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.