Home Other Building Blocks 1-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]cycloheptan-1-amine dihydrochloride

1-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]cycloheptan-1-amine dihydrochloride

CAS No.:
1423031-20-2
Catalog Number:
AG01A1QT
Molecular Formula:
C14H20Cl2N4O
Molecular Weight:
331.2408
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Product Description
Catalog Number:
AG01A1QT
Chemical Name:
1-[5-(pyridin-3-yl)-1,2,4-oxadiazol-3-yl]cycloheptan-1-amine dihydrochloride
CAS Number:
1423031-20-2
Molecular Formula:
C14H20Cl2N4O
Molecular Weight:
331.2408
MDL Number:
MFCD22565906
IUPAC Name:
1-(5-pyridin-3-yl-1,2,4-oxadiazol-3-yl)cycloheptan-1-amine;dihydrochloride
InChI:
InChI=1S/C14H18N4O.2ClH/c15-14(7-3-1-2-4-8-14)13-17-12(19-18-13)11-6-5-9-16-10-11;;/h5-6,9-10H,1-4,7-8,15H2;2*1H
InChI Key:
VVFARILRELTUJA-UHFFFAOYSA-N
SMILES:
NC1(CCCCCC1)c1noc(n1)c1cccnc1.Cl.Cl
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.101g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
331.241g/mol
Monoisotopic Mass:
330.101g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties