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918968-71-5 | 2-Oxazolidinone, 4-(1-methylethyl)-3-[2-(2-pyridinyl)ethyl]-, (4S)-
CAS No: 918968-71-5 Catalog No: AG006LJ0 MDL No:
Product Description
Catalog Number:
AG006LJ0
Chemical Name:
2-Oxazolidinone, 4-(1-methylethyl)-3-[2-(2-pyridinyl)ethyl]-, (4S)-
CAS Number:
918968-71-5
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
IUPAC Name:
(4S)-4-propan-2-yl-3-(2-pyridin-2-ylethyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C13H18N2O2/c1-10(2)12-9-17-13(16)15(12)8-6-11-5-3-4-7-14-11/h3-5,7,10,12H,6,8-9H2,1-2H3/t12-/m1/s1
InChI Key:
LKEMTJVSZYGVLT-GFCCVEGCSA-N
SMILES:
CC([C@H]1COC(=O)N1CCc1ccccn1)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
234.137g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.299g/mol
Monoisotopic Mass:
234.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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