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Home > Pyridines > 278614-84-9
278614-84-9 | 2-(piperazin-1-ylmethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
CAS No: 278614-84-9 Catalog No: AG019L2U MDL No:MFCD09802187
Product Description
Catalog Number:
AG019L2U
Chemical Name:
2-(piperazin-1-ylmethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
CAS Number:
278614-84-9
Molecular Formula:
C13H16N4O
Molecular Weight:
244.2923
MDL Number:
MFCD09802187
IUPAC Name:
2-(piperazin-1-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
InChI:
InChI=1S/C13H16N4O/c18-13-9-11(10-16-7-4-14-5-8-16)15-12-3-1-2-6-17(12)13/h1-3,6,9,14H,4-5,7-8,10H2
InChI Key:
RQXHRIPUYWEVNQ-UHFFFAOYSA-N
SMILES:
O=c1cc(CN2CCNCC2)nc2n1cccc2
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.298g/mol
Monoisotopic Mass:
244.132g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Literature
| Title | Journal |
|---|---|
| Synthesis and in vitro antiplatelet activity of new 4-(1-piperazinyl)coumarin derivatives. Human platelet phosphodiesterase 3 inhibitory properties of the two most effective compounds described and molecular modeling study on their interactions with phosphodiesterase 3A catalytic site. | Journal of medicinal chemistry 20070614 |
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