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Home > Indoles and Oxindole > 16131-73-0
16131-73-0 | 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-(2-thiazolyl)-
CAS No: 16131-73-0 Catalog No: AG001SCL MDL No:
Product Description
Catalog Number:
AG001SCL
Chemical Name:
4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-(2-thiazolyl)-
CAS Number:
16131-73-0
Molecular Formula:
C11H10N2O3S
Molecular Weight:
250.2737
IUPAC Name:
2-(1,3-thiazol-2-yl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
InChI:
InChI=1S/C11H10N2O3S/c14-9-7-5-1-2-6(16-5)8(7)10(15)13(9)11-12-3-4-17-11/h3-8H,1-2H2
InChI Key:
OSUOPKTZEWMPIE-UHFFFAOYSA-N
SMILES:
O=C1N(c2nccs2)C(=O)C2C1C1CCC2O1
NSC Number:
64860
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.041g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.272g/mol
Monoisotopic Mass:
250.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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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