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16141-50-7 | 2-Azetidinone, 1,3,4-triphenyl-, (3R,4R)-rel-
CAS No: 16141-50-7 Catalog No: AG001SGQ MDL No:
Product Description
Catalog Number:
AG001SGQ
Chemical Name:
2-Azetidinone, 1,3,4-triphenyl-, (3R,4R)-rel-
CAS Number:
16141-50-7
Molecular Formula:
C21H17NO
Molecular Weight:
299.3658
IUPAC Name:
(3S,4S)-1,3,4-triphenylazetidin-2-one
InChI:
InChI=1S/C21H17NO/c23-21-19(16-10-4-1-5-11-16)20(17-12-6-2-7-13-17)22(21)18-14-8-3-9-15-18/h1-15,19-20H/t19-,20+/m0/s1
InChI Key:
IUQCUELHHDRDJI-VQTJNVASSA-N
SMILES:
O=C1[C@H](c2ccccc2)[C@@H](N1c1ccccc1)c1ccccc1
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
299.131g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.373g/mol
Monoisotopic Mass:
299.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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