Home Other Building Blocks 5-CYANO-2-[4-BUTOXYCARBONYL-1-(1,4-DIAZEPENYL)]-PYRIDINE

5-CYANO-2-[4-BUTOXYCARBONYL-1-(1,4-DIAZEPENYL)]-PYRIDINE

CAS No.:
683274-60-4
Catalog Number:
AG00FEBD
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00FEBD
Chemical Name:
5-CYANO-2-[4-BUTOXYCARBONYL-1-(1,4-DIAZEPENYL)]-PYRIDINE
CAS Number:
683274-60-4
MDL Number:
MFCD03407523
IUPAC Name:
tert-butyl 4-(5-cyanopyridin-2-yl)-1,4-diazepane-1-carboxylate
InChI:
InChI=1S/C16H22N4O2/c1-16(2,3)22-15(21)20-8-4-7-19(9-10-20)14-6-5-13(11-17)12-18-14/h5-6,12H,4,7-10H2,1-3H3
InChI Key:
UVEBEHOJOFYOIC-UHFFFAOYSA-N
Properties
Complexity:
437  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.174g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.378g/mol
Monoisotopic Mass:
302.174g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties