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23348-34-7 | 3(2H)-Pyridazinone, 6-(2-methoxyphenyl)-2-[2-(4-morpholinyl)ethyl]-4-phenyl-, hydrochloride (1:?)
CAS No: 23348-34-7 Catalog No: AG002MY1 MDL No:
Product Description
Catalog Number:
AG002MY1
Chemical Name:
3(2H)-Pyridazinone, 6-(2-methoxyphenyl)-2-[2-(4-morpholinyl)ethyl]-4-phenyl-, hydrochloride (1:?)
CAS Number:
23348-34-7
Molecular Formula:
C23H26ClN3O3
Molecular Weight:
427.9238
IUPAC Name:
6-(2-methoxyphenyl)-2-(2-morpholin-4-ylethyl)-4-phenylpyridazin-3-one;hydrochloride
InChI:
InChI=1S/C23H25N3O3.ClH/c1-28-22-10-6-5-9-19(22)21-17-20(18-7-3-2-4-8-18)23(27)26(24-21)12-11-25-13-15-29-16-14-25;/h2-10,17H,11-16H2,1H3;1H
InChI Key:
WAEHTFJWRYVLLL-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1nn(CCN2CCOCC2)c(=O)c(c1)c1ccccc1.Cl
Properties
Complexity:
621
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
427.166g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
427.929g/mol
Monoisotopic Mass:
427.166g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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