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Home > Pyridines > 241488-24-4
241488-24-4 | 1-[4-(1H-pyrazol-5-yl)phenyl]-1,4-dihydropyridin-4-one
CAS No: 241488-24-4 Catalog No: AG00IMTR MDL No:MFCD00139310
Product Description
Catalog Number:
AG00IMTR
Chemical Name:
1-[4-(1H-pyrazol-5-yl)phenyl]-1,4-dihydropyridin-4-one
CAS Number:
241488-24-4
Molecular Formula:
C14H11N3O
Molecular Weight:
237.2566
MDL Number:
MFCD00139310
IUPAC Name:
1-[4-(1H-pyrazol-5-yl)phenyl]pyridin-4-one
InChI:
InChI=1S/C14H11N3O/c18-13-6-9-17(10-7-13)12-3-1-11(2-4-12)14-5-8-15-16-14/h1-10H,(H,15,16)
InChI Key:
JDEQPOPCQHAOPN-UHFFFAOYSA-N
SMILES:
O=c1ccn(cc1)c1ccc(cc1)c1ccn[nH]1
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.262g/mol
Monoisotopic Mass:
237.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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