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1480681-62-6 | Tert-Butyl (1-([1,2,4]Triazolo[4,3-A]Pyridin-3-Yl)Ethyl)Carbamate
CAS No: 1480681-62-6 Catalog No: AG00HXLY MDL No:MFCD21170056
Product Description
Catalog Number:
AG00HXLY
Chemical Name:
Tert-Butyl (1-([1,2,4]Triazolo[4,3-A]Pyridin-3-Yl)Ethyl)Carbamate
CAS Number:
1480681-62-6
Molecular Formula:
C13H18N4O2
Molecular Weight:
262.3076
MDL Number:
MFCD21170056
IUPAC Name:
tert-butyl N-[1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]carbamate
InChI:
InChI=1S/C13H18N4O2/c1-9(14-12(18)19-13(2,3)4)11-16-15-10-7-5-6-8-17(10)11/h5-9H,1-4H3,(H,14,18)
InChI Key:
YZUAOVCUGSBIPP-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(c1nnc2n1cccc2)C
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.143g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.313g/mol
Monoisotopic Mass:
262.143g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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