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23348-14-3 | 3(2H)-Pyridazinone, 6-(3-methoxyphenyl)-4-phenyl-2-[2-(1-piperidinyl)ethyl]-
CAS No: 23348-14-3 Catalog No: AG002MWU MDL No:
Product Description
Catalog Number:
AG002MWU
Chemical Name:
3(2H)-Pyridazinone, 6-(3-methoxyphenyl)-4-phenyl-2-[2-(1-piperidinyl)ethyl]-
CAS Number:
23348-14-3
Molecular Formula:
C24H27N3O2
Molecular Weight:
389.4901
IUPAC Name:
6-(3-methoxyphenyl)-4-phenyl-2-(2-piperidin-1-ylethyl)pyridazin-3-one
InChI:
InChI=1S/C24H27N3O2/c1-29-21-12-8-11-20(17-21)23-18-22(19-9-4-2-5-10-19)24(28)27(25-23)16-15-26-13-6-3-7-14-26/h2,4-5,8-12,17-18H,3,6-7,13-16H2,1H3
InChI Key:
JUCWRYLVUBHXMD-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)c1nn(CCN2CCCCC2)c(=O)c(c1)c1ccccc1
Properties
Complexity:
618
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.21g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
389.499g/mol
Monoisotopic Mass:
389.21g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
45.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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