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103286-94-8 | 2-Imidazolidinone,3-[5-(1,1-dimethylethyl)-3-pyridazinyl]-4-hydroxy-1-methyl-
CAS No: 103286-94-8 Catalog No: AG007XUP MDL No:
Product Description
Catalog Number:
AG007XUP
Chemical Name:
2-Imidazolidinone,3-[5-(1,1-dimethylethyl)-3-pyridazinyl]-4-hydroxy-1-methyl-
CAS Number:
103286-94-8
Molecular Formula:
C12H18N4O2
Molecular Weight:
250.2969
IUPAC Name:
3-(5-tert-butylpyridazin-3-yl)-4-hydroxy-1-methylimidazolidin-2-one
InChI:
InChI=1S/C12H18N4O2/c1-12(2,3)8-5-9(14-13-6-8)16-10(17)7-15(4)11(16)18/h5-6,10,17H,7H2,1-4H3
InChI Key:
QYRLDVZHWUYIPJ-UHFFFAOYSA-N
SMILES:
OC1CN(C(=O)N1c1nncc(c1)C(C)(C)C)C
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.143g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.302g/mol
Monoisotopic Mass:
250.143g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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