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879590-14-4 | (2-METHOXY-5-[1,3]OXAZOLO[4,5-B]PYRIDIN-2-YLPHENYL)AMINE
CAS No: 879590-14-4 Catalog No: AG004E8X MDL No:MFCD07613583
Product Description
Catalog Number:
AG004E8X
Chemical Name:
(2-METHOXY-5-[1,3]OXAZOLO[4,5-B]PYRIDIN-2-YLPHENYL)AMINE
CAS Number:
879590-14-4
Molecular Formula:
C13H11N3O2
Molecular Weight:
241.2453
MDL Number:
MFCD07613583
IUPAC Name:
2-methoxy-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)aniline
InChI:
InChI=1S/C13H11N3O2/c1-17-10-5-4-8(7-9(10)14)13-16-12-11(18-13)3-2-6-15-12/h2-7H,14H2,1H3
InChI Key:
BQYWCWWCDXAMOP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1N)c1nc2c(o1)cccn2
Properties
Complexity:
289
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:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.25g/mol
Monoisotopic Mass:
241.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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