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77671-26-2 | 2H-Imidazol-2-one, 1,3-dihydro-4-methyl-5-[4-(1-piperidinyl)benzoyl]-
CAS No: 77671-26-2 Catalog No: AG0058M4 MDL No:
Product Description
Catalog Number:
AG0058M4
Chemical Name:
2H-Imidazol-2-one, 1,3-dihydro-4-methyl-5-[4-(1-piperidinyl)benzoyl]-
CAS Number:
77671-26-2
Molecular Formula:
C16H19N3O2
Molecular Weight:
285.3410
IUPAC Name:
4-methyl-5-(4-piperidin-1-ylbenzoyl)-1,3-dihydroimidazol-2-one
InChI:
InChI=1S/C16H19N3O2/c1-11-14(18-16(21)17-11)15(20)12-5-7-13(8-6-12)19-9-3-2-4-10-19/h5-8H,2-4,9-10H2,1H3,(H2,17,18,21)
InChI Key:
RRWNGKIFTNSSTB-UHFFFAOYSA-N
SMILES:
O=C(c1[nH]c(=O)[nH]c1C)c1ccc(cc1)N1CCCCC1
Properties
Complexity:
458
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.148g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.347g/mol
Monoisotopic Mass:
285.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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