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Home > Pyridines > 1955531-00-6
1955531-00-6 | 5-(3-hydroxypyrrolidin-1-yl)-2-(piperidin-3-yl)-2,3-dihydropyridazin-3-one
CAS No: 1955531-00-6 Catalog No: AG01B4K4 MDL No:MFCD30180784
Product Description
Catalog Number:
AG01B4K4
Chemical Name:
5-(3-hydroxypyrrolidin-1-yl)-2-(piperidin-3-yl)-2,3-dihydropyridazin-3-one
CAS Number:
1955531-00-6
Molecular Formula:
C13H20N4O2
Molecular Weight:
264.3235
MDL Number:
MFCD30180784
IUPAC Name:
5-(3-hydroxypyrrolidin-1-yl)-2-piperidin-3-ylpyridazin-3-one
InChI:
InChI=1S/C13H20N4O2/c18-12-3-5-16(9-12)11-6-13(19)17(15-8-11)10-2-1-4-14-7-10/h6,8,10,12,14,18H,1-5,7,9H2
InChI Key:
DCAHDRLFEFNJPF-UHFFFAOYSA-N
SMILES:
OC1CCN(C1)c1cnn(c(=O)c1)C1CCCNC1
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.159g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.329g/mol
Monoisotopic Mass:
264.159g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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