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Home > Pyridines > 1803587-53-2
1803587-53-2 | 5-(azetidin-1-yl)-2-(piperidin-3-yl)-2,3-dihydropyridazin-3-one
CAS No: 1803587-53-2 Catalog No: AG01BE0Z MDL No:MFCD28246223
Product Description
Catalog Number:
AG01BE0Z
Chemical Name:
5-(azetidin-1-yl)-2-(piperidin-3-yl)-2,3-dihydropyridazin-3-one
CAS Number:
1803587-53-2
Molecular Formula:
C12H18N4O
Molecular Weight:
234.2975
MDL Number:
MFCD28246223
IUPAC Name:
5-(azetidin-1-yl)-2-piperidin-3-ylpyridazin-3-one
InChI:
InChI=1S/C12H18N4O/c17-12-7-11(15-5-2-6-15)9-14-16(12)10-3-1-4-13-8-10/h7,9-10,13H,1-6,8H2
InChI Key:
ZRIDWIZNTVGDDT-UHFFFAOYSA-N
SMILES:
O=c1cc(cnn1C1CCCNC1)N1CCC1
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.148g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.303g/mol
Monoisotopic Mass:
234.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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