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Home > Imidazoles > 860650-82-4
860650-82-4 | 3-benzyl-4-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-1,2-dihydropyridin-2-one
CAS No: 860650-82-4 Catalog No: AG00IPZ0 MDL No:MFCD03787417
Product Description
Catalog Number:
AG00IPZ0
Chemical Name:
3-benzyl-4-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-1,2-dihydropyridin-2-one
CAS Number:
860650-82-4
Molecular Formula:
C17H17N3O2
Molecular Weight:
295.3358
MDL Number:
MFCD03787417
IUPAC Name:
3-benzyl-4-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]pyridin-2-one
InChI:
InChI=1S/C17H17N3O2/c21-16-7-9-20(8-6-14-11-18-12-19-14)17(22)15(16)10-13-4-2-1-3-5-13/h1-5,7,9,11-12,21H,6,8,10H2,(H,18,19)
InChI Key:
BNWQQVNTPDKTJC-UHFFFAOYSA-N
SMILES:
Oc1ccn(c(=O)c1Cc1ccccc1)CCc1cnc[nH]1
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.132g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.342g/mol
Monoisotopic Mass:
295.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
69.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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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