Home Carboxys tert-butyl 3-sulfanyl-1H,5H,6H,7H,8H,8aH-imidazo[1,5-a]piperazine-7-carboxylate

tert-butyl 3-sulfanyl-1H,5H,6H,7H,8H,8aH-imidazo[1,5-a]piperazine-7-carboxylate

CAS No.:
1384427-68-2
Catalog Number:
AG019ZC3
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG019ZC3
Chemical Name:
tert-butyl 3-sulfanyl-1H,5H,6H,7H,8H,8aH-imidazo[1,5-a]piperazine-7-carboxylate
CAS Number:
1384427-68-2
MDL Number:
MFCD22369898
IUPAC Name:
tert-butyl 3-sulfanylidene-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazine-7-carboxylate
InChI:
InChI=1S/C11H19N3O2S/c1-11(2,3)16-10(15)13-4-5-14-8(7-13)6-12-9(14)17/h8H,4-7H2,1-3H3,(H,12,17)
InChI Key:
LFCBBXBPGMVCDV-UHFFFAOYSA-N
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.12g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.352g/mol
Monoisotopic Mass:
257.12g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties