Home Other Building Blocks tert-butyl N-(2-{5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)carbamate

tert-butyl N-(2-{5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)carbamate

CAS No.:
1443979-35-8
Catalog Number:
AG01A5Y9
Molecular Formula:
C13H22N4O2
Molecular Weight:
266.3394
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Product Description
Catalog Number:
AG01A5Y9
Chemical Name:
tert-butyl N-(2-{5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)carbamate
CAS Number:
1443979-35-8
Molecular Formula:
C13H22N4O2
Molecular Weight:
266.3394
MDL Number:
MFCD24843067
IUPAC Name:
tert-butyl N-[2-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]carbamate
InChI:
InChI=1S/C13H22N4O2/c1-13(2,3)19-12(18)14-8-7-11-16-15-10-6-4-5-9-17(10)11/h4-9H2,1-3H3,(H,14,18)
InChI Key:
UHLCIUOREURQFY-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCc1nnc2n1CCCC2
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.174g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
266.345g/mol
Monoisotopic Mass:
266.174g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
69A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties