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2037724-11-9

2037724-11-9 | 2-[(piperazin-1-yl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one dihydrochloride

CAS No: 2037724-11-9 Catalog No: AG01BVT0 MDL No:MFCD30497658

Product Description

Catalog Number:
AG01BVT0
Chemical Name:
2-[(piperazin-1-yl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one dihydrochloride
CAS Number:
2037724-11-9
Molecular Formula:
C13H18Cl2N4O
Molecular Weight:
317.2142
MDL Number:
MFCD30497658
IUPAC Name:
2-(piperazin-1-ylmethyl)pyrido[1,2-a]pyrimidin-4-one;dihydrochloride
InChI:
InChI=1S/C13H16N4O.2ClH/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;2*1H
InChI Key:
CXHOSQFOXIYWTB-UHFFFAOYSA-N
SMILES:
O=c1cc(CN2CCNCC2)nc2n1cccc2.Cl.Cl

Properties

Complexity:
469  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.086g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
317.214g/mol
Monoisotopic Mass:
316.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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