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39962-28-2 | N-(3,5-DIMETHYL-4-ISOXAZOLYLMETHYL)PHTHALIMIDE
CAS No: 39962-28-2 Catalog No: AG0076EV MDL No:
Product Description
Catalog Number:
AG0076EV
Chemical Name:
N-(3,5-DIMETHYL-4-ISOXAZOLYLMETHYL)PHTHALIMIDE
CAS Number:
39962-28-2
Molecular Formula:
C14H12N2O3
Molecular Weight:
256.2567
IUPAC Name:
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]isoindole-1,3-dione
InChI:
InChI=1S/C14H12N2O3/c1-8-12(9(2)19-15-8)7-16-13(17)10-5-3-4-6-11(10)14(16)18/h3-6H,7H2,1-2H3
InChI Key:
SHPRUADECKZSMQ-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2c(C)noc2C)C(=O)c2c1cccc2
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.085g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.261g/mol
Monoisotopic Mass:
256.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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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