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18159-93-8 | 1H-Pyrazolo[1,2-a]pyridazin-1-one, 5,6,7,8-tetrahydro-2-(2-hydroxyethyl)-3-methyl-
CAS No: 18159-93-8 Catalog No: AG0022YO MDL No:
Product Description
Catalog Number:
AG0022YO
Chemical Name:
1H-Pyrazolo[1,2-a]pyridazin-1-one, 5,6,7,8-tetrahydro-2-(2-hydroxyethyl)-3-methyl-
CAS Number:
18159-93-8
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
IUPAC Name:
2-(2-hydroxyethyl)-1-methyl-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-3-one
InChI:
InChI=1S/C10H16N2O2/c1-8-9(4-7-13)10(14)12-6-3-2-5-11(8)12/h13H,2-7H2,1H3
InChI Key:
ORJKQXRTOUWWQR-UHFFFAOYSA-N
SMILES:
OCCc1c(C)n2n(c1=O)CCCC2
NSC Number:
120312
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.25g/mol
Monoisotopic Mass:
196.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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