200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 1628795-45-8
1628795-45-8 | 6-(3,5-dimethoxyphenyl)-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one
CAS No: 1628795-45-8 Catalog No: AG01DK48 MDL No:
Product Description
Catalog Number:
AG01DK48
Chemical Name:
6-(3,5-dimethoxyphenyl)-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one
CAS Number:
1628795-45-8
Molecular Formula:
C16H15N3O3S
Molecular Weight:
329.3736
IUPAC Name:
6-(3,5-dimethoxyphenyl)-2-methylsulfanyl-8H-pyrido[2,3-d]pyrimidin-7-one
InChI:
InChI=1S/C16H15N3O3S/c1-21-11-4-9(5-12(7-11)22-2)13-6-10-8-17-16(23-3)19-14(10)18-15(13)20/h4-8H,1-3H3,(H,17,18,19,20)
InChI Key:
WQXRNJGXBBCXOD-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc(c1)c1cc2cnc(nc2[nH]c1=O)SC
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.083g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.374g/mol
Monoisotopic Mass:
329.083g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
98.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.