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149107-92-6 | 2-Azetidinone, 1-benzoyl-3-(1-methoxy-1-methylethoxy)-4-phenyl-, (3R,4S)-
CAS No: 149107-92-6 Catalog No: AG001LEZ MDL No:MFCD09750989
Product Description
Catalog Number:
AG001LEZ
Chemical Name:
2-Azetidinone, 1-benzoyl-3-(1-methoxy-1-methylethoxy)-4-phenyl-, (3R,4S)-
CAS Number:
149107-92-6
Molecular Formula:
C20H21NO4
Molecular Weight:
339.3850
MDL Number:
MFCD09750989
IUPAC Name:
(3R,4S)-1-benzoyl-3-(2-methoxypropan-2-yloxy)-4-phenylazetidin-2-one
InChI:
InChI=1S/C20H21NO4/c1-20(2,24-3)25-17-16(14-10-6-4-7-11-14)21(19(17)23)18(22)15-12-8-5-9-13-15/h4-13,16-17H,1-3H3/t16-,17+/m0/s1
InChI Key:
SVGIEMHCAPRHEZ-DLBZAZTESA-N
SMILES:
COC(O[C@H]1C(=O)N([C@H]1c1ccccc1)C(=O)c1ccccc1)(C)C
Properties
Complexity:
492
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
339.147g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.391g/mol
Monoisotopic Mass:
339.147g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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