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16311-94-7 | 2-Azetidinone, 3-azido-1,4-diphenyl-, (3R,4S)-rel-
CAS No: 16311-94-7 Catalog No: AG001TSC MDL No:
Product Description
Catalog Number:
AG001TSC
Chemical Name:
2-Azetidinone, 3-azido-1,4-diphenyl-, (3R,4S)-rel-
CAS Number:
16311-94-7
Molecular Formula:
C15H12N4O
Molecular Weight:
264.2820
IUPAC Name:
(3S,4R)-3-azido-1,4-diphenylazetidin-2-one
InChI:
InChI=1S/C15H12N4O/c16-18-17-13-14(11-7-3-1-4-8-11)19(15(13)20)12-9-5-2-6-10-12/h1-10,13-14H/t13-,14+/m0/s1
InChI Key:
QXVSDJNBVKPWMJ-UONOGXRCSA-N
SMILES:
[N-]=[N+]=N[C@H]1C(=O)N([C@H]1c1ccccc1)c1ccccc1
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
264.101g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.288g/mol
Monoisotopic Mass:
264.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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