Home Other Building Blocks 3-N-ethyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazole-3,5-diamine

3-N-ethyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazole-3,5-diamine

CAS No.:
1188304-98-4
Catalog Number:
AG01BEDG
Molecular Formula:
C13H14N6O
Molecular Weight:
270.2899
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Product Description
Catalog Number:
AG01BEDG
Chemical Name:
3-N-ethyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazole-3,5-diamine
CAS Number:
1188304-98-4
Molecular Formula:
C13H14N6O
Molecular Weight:
270.2899
MDL Number:
MFCD28064057
IUPAC Name:
3-N-ethyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-pyrazole-3,5-diamine
InChI:
InChI=1S/C13H14N6O/c1-2-15-12-9(10(14)17-18-12)13-16-11(19-20-13)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H4,14,15,17,18)
InChI Key:
SBZPSDULPHZFIB-UHFFFAOYSA-N
SMILES:
CCNc1n[nH]c(c1c1onc(n1)c1ccccc1)N
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.123g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
270.296g/mol
Monoisotopic Mass:
270.123g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties