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116121-61-0 | Pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione, 5-ethyl-1,3-dimethyl-
CAS No: 116121-61-0 Catalog No: AG000BOP MDL No:
Product Description
Catalog Number:
AG000BOP
Chemical Name:
Pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione, 5-ethyl-1,3-dimethyl-
CAS Number:
116121-61-0
Molecular Formula:
C11H13N3O2
Molecular Weight:
219.2398
IUPAC Name:
5-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
InChI:
InChI=1S/C11H13N3O2/c1-4-7-5-6-12-9-8(7)10(15)14(3)11(16)13(9)2/h5-6H,4H2,1-3H3
InChI Key:
STADYDZJZGPIAD-UHFFFAOYSA-N
SMILES:
CCc1ccnc2c1c(=O)n(C)c(=O)n2C
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.101g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.244g/mol
Monoisotopic Mass:
219.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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