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1153231-27-6

1153231-27-6 | 6-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-2-methyl-2,3-dihydropyridazin-3-one

CAS No: 1153231-27-6 Catalog No: AG01A9VA MDL No:MFCD12739808

Product Description

Catalog Number:
AG01A9VA
Chemical Name:
6-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-2-methyl-2,3-dihydropyridazin-3-one
CAS Number:
1153231-27-6
Molecular Formula:
C12H18N4O3
Molecular Weight:
266.2963
MDL Number:
MFCD12739808
IUPAC Name:
6-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-2-methylpyridazin-3-one
InChI:
InChI=1S/C12H18N4O3/c1-14-11(18)3-2-10(13-14)12(19)16-6-4-15(5-7-16)8-9-17/h2-3,17H,4-9H2,1H3
InChI Key:
NMIJOHIWZACUMG-UHFFFAOYSA-N
SMILES:
OCCN1CCN(CC1)C(=O)c1ccc(=O)n(n1)C

Properties

Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.138g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
266.301g/mol
Monoisotopic Mass:
266.138g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  

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