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Home > Imidazoles > 136949-32-1
136949-32-1 | 5-Furan-2-ylmethylene-imidazolidine-2,4-dione
CAS No: 136949-32-1 Catalog No: AG01672Y MDL No:
Product Description
Catalog Number:
AG01672Y
Chemical Name:
5-Furan-2-ylmethylene-imidazolidine-2,4-dione
CAS Number:
136949-32-1
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
IUPAC Name:
(5Z)-5-(furan-2-ylmethylidene)imidazolidine-2,4-dione
InChI:
InChI=1S/C8H6N2O3/c11-7-6(9-8(12)10-7)4-5-2-1-3-13-5/h1-4H,(H2,9,10,11,12)/b6-4-
InChI Key:
NTRZCUHJPUNEDE-XQRVVYSFSA-N
SMILES:
O=C1NC(=O)/C(=C/c2ccco2)/N1
NSC Number:
170416
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
178.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.147g/mol
Monoisotopic Mass:
178.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Privileged scaffolds or promiscuous binders: a comparative study on rhodanines and related heterocycles in medicinal chemistry. | Journal of medicinal chemistry 20120126 |
| 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 |
| Anticonvulsant activity of phenylmethylenehydantoins: a structure-activity relationship study. | Journal of medicinal chemistry 20040311 |
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