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88628-98-2 | Pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione, 1,3-diethyl-
CAS No: 88628-98-2 Catalog No: AG004A7Y MDL No:
Product Description
Catalog Number:
AG004A7Y
Chemical Name:
Pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione, 1,3-diethyl-
CAS Number:
88628-98-2
Molecular Formula:
C11H13N3O2
Molecular Weight:
219.2398
IUPAC Name:
1,3-diethylpyrido[2,3-d]pyrimidine-2,4-dione
InChI:
InChI=1S/C11H13N3O2/c1-3-13-9-8(6-5-7-12-9)10(15)14(4-2)11(13)16/h5-7H,3-4H2,1-2H3
InChI Key:
WUJCZDHKZJXLOF-UHFFFAOYSA-N
SMILES:
CCn1c2ncccc2c(=O)n(c1=O)CC
Properties
Complexity:
306
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:
2
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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