Home Halogens 4-bromo-2-methyl-5-{[(piperidin-2-yl)methyl]amino}-2,3-dihydropyridazin-3-one hydrochloride

4-bromo-2-methyl-5-{[(piperidin-2-yl)methyl]amino}-2,3-dihydropyridazin-3-one hydrochloride

CAS No.:
2060031-55-0
Catalog Number:
AG01BRJT
Molecular Formula:
C11H18BrClN4O
Molecular Weight:
337.6438
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Product Description
Catalog Number:
AG01BRJT
Chemical Name:
4-bromo-2-methyl-5-{[(piperidin-2-yl)methyl]amino}-2,3-dihydropyridazin-3-one hydrochloride
CAS Number:
2060031-55-0
Molecular Formula:
C11H18BrClN4O
Molecular Weight:
337.6438
MDL Number:
MFCD30535763
IUPAC Name:
4-bromo-2-methyl-5-(piperidin-2-ylmethylamino)pyridazin-3-one;hydrochloride
InChI:
InChI=1S/C11H17BrN4O.ClH/c1-16-11(17)10(12)9(7-15-16)14-6-8-4-2-3-5-13-8;/h7-8,13-14H,2-6H2,1H3;1H
InChI Key:
JLRQITAFKWKXTJ-UHFFFAOYSA-N
SMILES:
Cn1ncc(c(c1=O)Br)NCC1CCCCN1.Cl
Properties
Complexity:
367  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.035g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
337.646g/mol
Monoisotopic Mass:
336.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties