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191219-86-0 | Pyrido[2,3-d]pyrimidin-2(1H)-one, 4-cyclohexyl-1-ethyl-7-methyl-
CAS No: 191219-86-0 Catalog No: AG002F4X MDL No:
Product Description
Catalog Number:
AG002F4X
Chemical Name:
Pyrido[2,3-d]pyrimidin-2(1H)-one, 4-cyclohexyl-1-ethyl-7-methyl-
CAS Number:
191219-86-0
Molecular Formula:
C16H21N3O
Molecular Weight:
271.3574
IUPAC Name:
4-cyclohexyl-1-ethyl-7-methylpyrido[2,3-d]pyrimidin-2-one
InChI:
InChI=1S/C16H21N3O/c1-3-19-15-13(10-9-11(2)17-15)14(18-16(19)20)12-7-5-4-6-8-12/h9-10,12H,3-8H2,1-2H3
InChI Key:
AFORUUDXYIKHFK-UHFFFAOYSA-N
SMILES:
CCn1c(=O)nc(c2c1nc(C)cc2)C1CCCCC1
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.168g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.364g/mol
Monoisotopic Mass:
271.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Elucidation of the effects of the CYP1A2 deficiency polymorphism in the metabolism of 4-cyclohexyl-1-ethyl-7-methylpyrido[2,3-d]pyrimidine-2-(1h)-one (YM-64227), a phosphodiesterase type 4 inhibitor, and its metabolites in dogs. | Drug metabolism and disposition: the biological fate of chemicals 20061101 |
| The canine CYP1A2 deficiency polymorphism dramatically affects the pharmacokinetics of 4-cyclohexyl-1-ethyl-7-methylpyrido[2,3-D]-pyrimidine-2-(1H)-one (YM-64227), a phosphodiesterase type 4 inhibitor. | Drug metabolism and disposition: the biological fate of chemicals 20060501 |
| Simultaneous determination of YM-64227, a phosphodiesterase type 4 inhibitor, and its five metabolites in dog plasma by high-performance liquid chromatography with fluorescence detection. | Biomedical chromatography : BMC 20041101 |
| Identification of the novel canine CYP1A2 1117 C > T SNP causing protein deletion. | Xenobiotica; the fate of foreign compounds in biological systems 20040901 |
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