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Home > Pyridines > 132814-16-5
132814-16-5 | 3(2H)-Pyridazinone, 6-phenyl-5-(1-piperazinyl)-
CAS No: 132814-16-5 Catalog No: AG00117M MDL No:MFCD02571097
Product Description
Catalog Number:
AG00117M
Chemical Name:
3(2H)-Pyridazinone, 6-phenyl-5-(1-piperazinyl)-
CAS Number:
132814-16-5
Molecular Formula:
C14H16N4O
Molecular Weight:
256.3030
MDL Number:
MFCD02571097
IUPAC Name:
3-phenyl-4-piperazin-1-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C14H16N4O/c19-13-10-12(18-8-6-15-7-9-18)14(17-16-13)11-4-2-1-3-5-11/h1-5,10,15H,6-9H2,(H,16,19)
InChI Key:
BTLOOVKBRJZVLB-UHFFFAOYSA-N
SMILES:
O=c1[nH]nc(c(c1)N1CCNCC1)c1ccccc1
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.132g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.309g/mol
Monoisotopic Mass:
256.132g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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