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101937-73-9 | Propanamide, 2-chloro-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-
CAS No: 101937-73-9 Catalog No: AG00060H MDL No:MFCD03147406
Product Description
Catalog Number:
AG00060H
Chemical Name:
Propanamide, 2-chloro-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-
CAS Number:
101937-73-9
Molecular Formula:
C14H16ClN3O2
Molecular Weight:
293.7487
MDL Number:
MFCD03147406
IUPAC Name:
2-chloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)propanamide
InChI:
InChI=1S/C14H16ClN3O2/c1-9(15)13(19)16-12-10(2)17(3)18(14(12)20)11-7-5-4-6-8-11/h4-9H,1-3H3,(H,16,19)
InChI Key:
MORLKTUKTJISOL-UHFFFAOYSA-N
SMILES:
O=C(C(Cl)C)Nc1c(C)n(n(c1=O)c1ccccc1)C
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.093g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.751g/mol
Monoisotopic Mass:
293.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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