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Home > Pyridines > 478247-71-1
478247-71-1 | 3-benzyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-1,2-dihydropyridin-2-one
CAS No: 478247-71-1 Catalog No: AG00IRFE MDL No:MFCD01871743
Product Description
Catalog Number:
AG00IRFE
Chemical Name:
3-benzyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-1,2-dihydropyridin-2-one
CAS Number:
478247-71-1
Molecular Formula:
C22H23NO4
Molecular Weight:
365.4223
MDL Number:
MFCD01871743
IUPAC Name:
3-benzyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxypyridin-2-one
InChI:
InChI=1S/C22H23NO4/c1-26-20-9-8-17(15-21(20)27-2)10-12-23-13-11-19(24)18(22(23)25)14-16-6-4-3-5-7-16/h3-9,11,13,15,24H,10,12,14H2,1-2H3
InChI Key:
DZLFYHLSRYOYSB-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)CCn1ccc(c(c1=O)Cc1ccccc1)O
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.163g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
365.429g/mol
Monoisotopic Mass:
365.163g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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