200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 256461-28-6
256461-28-6 | 1H-Imidazole-4-carboxamide, 1-[1-(hydroxymethyl)-3-phenylpropyl]-
CAS No: 256461-28-6 Catalog No: AG007MGC MDL No:
Product Description
Catalog Number:
AG007MGC
Chemical Name:
1H-Imidazole-4-carboxamide, 1-[1-(hydroxymethyl)-3-phenylpropyl]-
CAS Number:
256461-28-6
Molecular Formula:
C14H17N3O2
Molecular Weight:
259.3037
IUPAC Name:
1-(1-hydroxy-4-phenylbutan-2-yl)imidazole-4-carboxamide
InChI:
InChI=1S/C14H17N3O2/c15-14(19)13-8-17(10-16-13)12(9-18)7-6-11-4-2-1-3-5-11/h1-5,8,10,12,18H,6-7,9H2,(H2,15,19)
InChI Key:
ZUYUIKKHHBEVHL-UHFFFAOYSA-N
SMILES:
OCC(n1cnc(c1)C(=O)N)CCc1ccccc1
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.132g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
259.309g/mol
Monoisotopic Mass:
259.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Structure based de novo design of novel glycogen synthase kinase 3 inhibitors. | Bioorganic & medicinal chemistry 20070601 |
| Structure-based design, synthesis, and structure-activity relationship studies of novel non-nucleoside adenosine deaminase inhibitors. | Journal of medicinal chemistry 20040715 |
| Structure-based design and synthesis of non-nucleoside, potent, and orally bioavailable adenosine deaminase inhibitors. | Journal of medicinal chemistry 20040520 |
| Structure-based de novo design of non-nucleoside adenosine deaminase inhibitors. | Bioorganic & medicinal chemistry letters 20030324 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.