200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 117038-05-8
117038-05-8 | 4(3H)-Quinazolinone, 3-phenyl-2-[(2-pyridinylmethyl)sulfinyl]-
CAS No: 117038-05-8 Catalog No: AG000DM2 MDL No:
Product Description
Catalog Number:
AG000DM2
Chemical Name:
4(3H)-Quinazolinone, 3-phenyl-2-[(2-pyridinylmethyl)sulfinyl]-
CAS Number:
117038-05-8
Molecular Formula:
C20H15N3O2S
Molecular Weight:
361.4170
IUPAC Name:
3-phenyl-2-(pyridin-2-ylmethylsulfinyl)quinazolin-4-one
InChI:
InChI=1S/C20H15N3O2S/c24-19-17-11-4-5-12-18(17)22-20(23(19)16-9-2-1-3-10-16)26(25)14-15-8-6-7-13-21-15/h1-13H,14H2
InChI Key:
RQODJPLBSBDZLJ-UHFFFAOYSA-N
SMILES:
O=S(c1nc2ccccc2c(=O)n1c1ccccc1)Cc1ccccn1
Properties
Complexity:
573
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.088g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.419g/mol
Monoisotopic Mass:
361.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.