200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 27430-50-8
27430-50-8 | 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanenitrile
CAS No: 27430-50-8 Catalog No: AG019MJR MDL No:MFCD06382836
Product Description
Catalog Number:
AG019MJR
Chemical Name:
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanenitrile
CAS Number:
27430-50-8
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
MDL Number:
MFCD06382836
IUPAC Name:
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanenitrile
InChI:
InChI=1S/C8H11N3O2/c1-8(2)6(12)11(5-3-4-9)7(13)10-8/h3,5H2,1-2H3,(H,10,13)
InChI Key:
YVFPANAAHOFIGJ-UHFFFAOYSA-N
SMILES:
N#CCCN1C(=O)NC(C1=O)(C)C
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.085g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.195g/mol
Monoisotopic Mass:
181.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.