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88421-06-1 | Urea, N,N-dimethyl-N'-[2-(6-oxo-3-phenyl-1(6H)-pyridazinyl)ethyl]-
CAS No: 88421-06-1 Catalog No: AG004HU6 MDL No:
Product Description
Catalog Number:
AG004HU6
Chemical Name:
Urea, N,N-dimethyl-N'-[2-(6-oxo-3-phenyl-1(6H)-pyridazinyl)ethyl]-
CAS Number:
88421-06-1
Molecular Formula:
C15H18N4O2
Molecular Weight:
286.3290
IUPAC Name:
1,1-dimethyl-3-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]urea
InChI:
InChI=1S/C15H18N4O2/c1-18(2)15(21)16-10-11-19-14(20)9-8-13(17-19)12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3,(H,16,21)
InChI Key:
UAFYPHNYOAMGSP-UHFFFAOYSA-N
SMILES:
CN(C(=O)NCCn1nc(ccc1=O)c1ccccc1)C
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.143g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.335g/mol
Monoisotopic Mass:
286.143g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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