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1422064-84-3

1422064-84-3 | N-((octahydrocyclopenta[b][1,4]oxazin-7-yl)methyl)pyridazine-4-carboxamide

CAS No: 1422064-84-3 Catalog No: AG01DI2X MDL No:

Product Description

Catalog Number:
AG01DI2X
Chemical Name:
N-((octahydrocyclopenta[b][1,4]oxazin-7-yl)methyl)pyridazine-4-carboxamide
CAS Number:
1422064-84-3
Molecular Formula:
C13H18N4O2
Molecular Weight:
262.3076
IUPAC Name:
N-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b][1,4]oxazin-7-ylmethyl)pyridazine-4-carboxamide
InChI:
InChI=1S/C13H18N4O2/c18-13(10-3-4-16-17-8-10)15-7-9-1-2-11-12(9)19-6-5-14-11/h3-4,8-9,11-12,14H,1-2,5-7H2,(H,15,18)
InChI Key:
ZKNPCGIHNFWAOZ-UHFFFAOYSA-N
SMILES:
O=C(c1ccnnc1)NCC1CCC2C1OCCN2

Properties

Complexity:
326  
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:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
262.313g/mol
Monoisotopic Mass:
262.143g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  

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