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Home > Aldehydes > 154816-49-6
154816-49-6 | 2-(4-METHYL-PIPERAZIN-1-YL)-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDINE-3-CARBALDEHYDE
CAS No: 154816-49-6 Catalog No: AG00ABAP MDL No:MFCD03285279
Product Description
Catalog Number:
AG00ABAP
Chemical Name:
2-(4-METHYL-PIPERAZIN-1-YL)-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDINE-3-CARBALDEHYDE
CAS Number:
154816-49-6
Molecular Formula:
C14H16N4O2
Molecular Weight:
272.3024
MDL Number:
MFCD03285279
IUPAC Name:
2-(4-methylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carbaldehyde
InChI:
InChI=1S/C14H16N4O2/c1-16-6-8-17(9-7-16)13-11(10-19)14(20)18-5-3-2-4-12(18)15-13/h2-5,10H,6-9H2,1H3
InChI Key:
ZYEGEPJJCWHUAE-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n(c1=O)cccc2)N1CCN(CC1)C
Properties
Complexity:
566
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.127g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.308g/mol
Monoisotopic Mass:
272.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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