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23338-47-8 | 3(2H)-Pyridazinone, 4-(4-methylphenyl)-2-[2-(4-morpholinyl)ethyl]-6-phenyl-
CAS No: 23338-47-8 Catalog No: AG002MWB MDL No:
Product Description
Catalog Number:
AG002MWB
Chemical Name:
3(2H)-Pyridazinone, 4-(4-methylphenyl)-2-[2-(4-morpholinyl)ethyl]-6-phenyl-
CAS Number:
23338-47-8
Molecular Formula:
C23H25N3O2
Molecular Weight:
375.4635
IUPAC Name:
4-(4-methylphenyl)-2-(2-morpholin-4-ylethyl)-6-phenylpyridazin-3-one
InChI:
InChI=1S/C23H25N3O2/c1-18-7-9-19(10-8-18)21-17-22(20-5-3-2-4-6-20)24-26(23(21)27)12-11-25-13-15-28-16-14-25/h2-10,17H,11-16H2,1H3
InChI Key:
YSQODNGHZVLWQA-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1cc(nn(c1=O)CCN1CCOCC1)c1ccccc1
Properties
Complexity:
595
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.195g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.472g/mol
Monoisotopic Mass:
375.195g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
45.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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