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52333-90-1 | 3-oxazolo[4,5-b]pyridin-2-yl-aniline
CAS No: 52333-90-1 Catalog No: AG00DCTN MDL No:MFCD00606406
Product Description
Catalog Number:
AG00DCTN
Chemical Name:
3-oxazolo[4,5-b]pyridin-2-yl-aniline
CAS Number:
52333-90-1
Molecular Formula:
C12H9N3O
Molecular Weight:
211.2194
MDL Number:
MFCD00606406
IUPAC Name:
3-([1,3]oxazolo[4,5-b]pyridin-2-yl)aniline
InChI:
InChI=1S/C12H9N3O/c13-9-4-1-3-8(7-9)12-15-11-10(16-12)5-2-6-14-11/h1-7H,13H2
InChI Key:
HKWQPWPKROMXCJ-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)c1nc2c(o1)cccn2
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.075g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.224g/mol
Monoisotopic Mass:
211.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
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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