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415678-40-9 | 4-Imidazolidinone,3-methyl-2-(5-methyl-2-furanyl)-5-(phenylmethyl)-, (2S,5S)-
CAS No: 415678-40-9 Catalog No: AG0071U6 MDL No:
Product Description
Catalog Number:
AG0071U6
Chemical Name:
4-Imidazolidinone,3-methyl-2-(5-methyl-2-furanyl)-5-(phenylmethyl)-, (2S,5S)-
CAS Number:
415678-40-9
Molecular Formula:
C16H18N2O2
Molecular Weight:
270.3263
IUPAC Name:
(2S,5S)-5-benzyl-3-methyl-2-(5-methylfuran-2-yl)imidazolidin-4-one
InChI:
InChI=1S/C16H18N2O2/c1-11-8-9-14(20-11)15-17-13(16(19)18(15)2)10-12-6-4-3-5-7-12/h3-9,13,15,17H,10H2,1-2H3/t13-,15-/m0/s1
InChI Key:
IQIMPHPFMHVWBZ-ZFWWWQNUSA-N
SMILES:
Cc1ccc(o1)[C@H]1N[C@H](C(=O)N1C)Cc1ccccc1
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
270.137g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.332g/mol
Monoisotopic Mass:
270.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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