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114212-82-7 | 4-Morpholinecarboximidamide, N-(3-phenyl-1,2,4-oxadiazol-5-yl)-
CAS No: 114212-82-7 Catalog No: AG000AT5 MDL No:
Product Description
Catalog Number:
AG000AT5
Chemical Name:
4-Morpholinecarboximidamide, N-(3-phenyl-1,2,4-oxadiazol-5-yl)-
CAS Number:
114212-82-7
Molecular Formula:
C13H15N5O2
Molecular Weight:
273.2905
IUPAC Name:
N'-(3-phenyl-1,2,4-oxadiazol-5-yl)morpholine-4-carboximidamide
InChI:
InChI=1S/C13H15N5O2/c14-12(18-6-8-19-9-7-18)16-13-15-11(17-20-13)10-4-2-1-3-5-10/h1-5H,6-9H2,(H2,14,15,16,17)
InChI Key:
DSTNMZODZHXOGA-UHFFFAOYSA-N
SMILES:
N=C(N1CCOCC1)Nc1onc(n1)c1ccccc1
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.123g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.296g/mol
Monoisotopic Mass:
273.123g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.8
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