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6975-58-2 | 4(5H)-Thiazolone,5-(2-furanylmethylene)-2-(4-morpholinyl)-
CAS No: 6975-58-2 Catalog No: AG0067NI MDL No:
Product Description
Catalog Number:
AG0067NI
Chemical Name:
4(5H)-Thiazolone,5-(2-furanylmethylene)-2-(4-morpholinyl)-
CAS Number:
6975-58-2
Molecular Formula:
C12H12N2O3S
Molecular Weight:
264.3003
IUPAC Name:
5-(furan-2-ylmethylidene)-2-morpholin-4-yl-1,3-thiazol-4-one
InChI:
InChI=1S/C12H12N2O3S/c15-11-10(8-9-2-1-5-17-9)18-12(13-11)14-3-6-16-7-4-14/h1-2,5,8H,3-4,6-7H2
InChI Key:
VVWQIOMMRSWLGV-UHFFFAOYSA-N
SMILES:
O=C1N=C(SC1=Cc1ccco1)N1CCOCC1
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.057g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.299g/mol
Monoisotopic Mass:
264.057g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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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