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1012344-09-0 | 4-{6-[(3-hydroxypropyl)amino]imidazo[1,2-b]pyridazin-3-yl}phenol
CAS No: 1012344-09-0 Catalog No: AG01BARQ MDL No:MFCD26392215
Product Description
Catalog Number:
AG01BARQ
Chemical Name:
4-{6-[(3-hydroxypropyl)amino]imidazo[1,2-b]pyridazin-3-yl}phenol
CAS Number:
1012344-09-0
Molecular Formula:
C15H16N4O2
Molecular Weight:
284.3131
MDL Number:
MFCD26392215
IUPAC Name:
4-[6-(3-hydroxypropylamino)imidazo[1,2-b]pyridazin-3-yl]phenol
InChI:
InChI=1S/C15H16N4O2/c20-9-1-8-16-14-6-7-15-17-10-13(19(15)18-14)11-2-4-12(21)5-3-11/h2-7,10,20-21H,1,8-9H2,(H,16,18)
InChI Key:
KOXVNSVKNGZIHN-UHFFFAOYSA-N
SMILES:
OCCCNc1ccc2n(n1)c(cn2)c1ccc(cc1)O
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.127g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
284.319g/mol
Monoisotopic Mass:
284.127g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
82.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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