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82239-54-1 | Ethanol, 2-[[2-[(4-methyl-6-phenyl-3-pyridazinyl)amino]ethyl]amino]-
CAS No: 82239-54-1 Catalog No: AG0056DF MDL No:
Product Description
Catalog Number:
AG0056DF
Chemical Name:
Ethanol, 2-[[2-[(4-methyl-6-phenyl-3-pyridazinyl)amino]ethyl]amino]-
CAS Number:
82239-54-1
Molecular Formula:
C15H20N4O
Molecular Weight:
272.3455
IUPAC Name:
2-[2-[(4-methyl-6-phenylpyridazin-3-yl)amino]ethylamino]ethanol
InChI:
InChI=1S/C15H20N4O/c1-12-11-14(13-5-3-2-4-6-13)18-19-15(12)17-8-7-16-9-10-20/h2-6,11,16,20H,7-10H2,1H3,(H,17,19)
InChI Key:
COJQPXLVUWWFMN-UHFFFAOYSA-N
SMILES:
OCCNCCNc1nnc(cc1C)c1ccccc1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.164g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
272.352g/mol
Monoisotopic Mass:
272.164g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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