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708987-60-4 | N-(1H-indol-5-yl)-5-methyl-3-isoxazolecarboxamide
CAS No: 708987-60-4 Catalog No: AG01CAQG MDL No:MFCD03055809
Product Description
Catalog Number:
AG01CAQG
Chemical Name:
N-(1H-indol-5-yl)-5-methyl-3-isoxazolecarboxamide
CAS Number:
708987-60-4
Molecular Formula:
C13H11N3O2
Molecular Weight:
241.2453
MDL Number:
MFCD03055809
IUPAC Name:
N-(1H-indol-5-yl)-5-methyl-1,2-oxazole-3-carboxamide
InChI:
InChI=1S/C13H11N3O2/c1-8-6-12(16-18-8)13(17)15-10-2-3-11-9(7-10)4-5-14-11/h2-7,14H,1H3,(H,15,17)
InChI Key:
VJGHVVSAQTZVLK-UHFFFAOYSA-N
SMILES:
Cc1onc(c1)C(=O)Nc1ccc2c(c1)cc[nH]2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.25g/mol
Monoisotopic Mass:
241.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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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