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1422135-70-3

1422135-70-3 | N-(pyridin-3-yl)-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridine-3-carboxamide

CAS No: 1422135-70-3 Catalog No: AG01DHGN MDL No:

Product Description

Catalog Number:
AG01DHGN
Chemical Name:
N-(pyridin-3-yl)-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridine-3-carboxamide
CAS Number:
1422135-70-3
Molecular Formula:
C12H12N4O2
Molecular Weight:
244.2493
IUPAC Name:
N-pyridin-3-yl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridine-3-carboxamide
InChI:
InChI=1S/C12H12N4O2/c17-12(15-8-2-1-4-13-6-8)11-9-7-14-5-3-10(9)18-16-11/h1-2,4,6,14H,3,5,7H2,(H,15,17)
InChI Key:
ANERSGJDSSZSAE-UHFFFAOYSA-N
SMILES:
O=C(c1noc2c1CNCC2)Nc1cccnc1

Properties

Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.254g/mol
Monoisotopic Mass:
244.096g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  

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