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478247-65-3 | 3-benzyl-1-[(furan-2-yl)methyl]-4-hydroxy-1,2-dihydropyridin-2-one
CAS No: 478247-65-3 Catalog No: AG00IW2R MDL No:MFCD01871741
Product Description
Catalog Number:
AG00IW2R
Chemical Name:
3-benzyl-1-[(furan-2-yl)methyl]-4-hydroxy-1,2-dihydropyridin-2-one
CAS Number:
478247-65-3
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
MDL Number:
MFCD01871741
IUPAC Name:
3-benzyl-1-(furan-2-ylmethyl)-4-hydroxypyridin-2-one
InChI:
InChI=1S/C17H15NO3/c19-16-8-9-18(12-14-7-4-10-21-14)17(20)15(16)11-13-5-2-1-3-6-13/h1-10,19H,11-12H2
InChI Key:
QOUHLDJYYZJFJP-UHFFFAOYSA-N
SMILES:
Oc1ccn(c(=O)c1Cc1ccccc1)Cc1ccco1
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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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