200,000+ products from a single source!
sales@angenechem.com
141692-27-5 | 2,4(1H,3H)-Pyrimidinedione, 5-[methyl(phenylmethyl)amino]-
CAS No: 141692-27-5 Catalog No: AG001GWQ MDL No:
Product Description
Catalog Number:
AG001GWQ
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 5-[methyl(phenylmethyl)amino]-
CAS Number:
141692-27-5
Molecular Formula:
C12H13N3O2
Molecular Weight:
231.2505
IUPAC Name:
5-[benzyl(methyl)amino]-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C12H13N3O2/c1-15(8-9-5-3-2-4-6-9)10-7-13-12(17)14-11(10)16/h2-7H,8H2,1H3,(H2,13,14,16,17)
InChI Key:
WGUSNQQQDQSGMD-UHFFFAOYSA-N
SMILES:
CN(c1c[nH]c(=O)[nH]c1=O)Cc1ccccc1
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.255g/mol
Monoisotopic Mass:
231.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.