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Home > Pyridines > 1017601-66-9
1017601-66-9 | 4(1H)-Pyridinone, 5,6-dihydro-3-(3-hydroxyphenyl)-1-(phenylmethyl)-
CAS No: 1017601-66-9 Catalog No: AG0005F2 MDL No:
Product Description
Catalog Number:
AG0005F2
Chemical Name:
4(1H)-Pyridinone, 5,6-dihydro-3-(3-hydroxyphenyl)-1-(phenylmethyl)-
CAS Number:
1017601-66-9
Molecular Formula:
C18H17NO2
Molecular Weight:
279.3331
IUPAC Name:
1-benzyl-5-(3-hydroxyphenyl)-2,3-dihydropyridin-4-one
InChI:
InChI=1S/C18H17NO2/c20-16-8-4-7-15(11-16)17-13-19(10-9-18(17)21)12-14-5-2-1-3-6-14/h1-8,11,13,20H,9-10,12H2
InChI Key:
JHXUBGDRHLWEPE-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)C1=CN(CCC1=O)Cc1ccccc1
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.339g/mol
Monoisotopic Mass:
279.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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