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88148-99-6 | Acetamide, N-[3-(methylthio)-2-oxo-3-azetidinyl]-2-phenoxy-
CAS No: 88148-99-6 Catalog No: AG004G9A MDL No:
Product Description
Catalog Number:
AG004G9A
Chemical Name:
Acetamide, N-[3-(methylthio)-2-oxo-3-azetidinyl]-2-phenoxy-
CAS Number:
88148-99-6
Molecular Formula:
C12H14N2O3S
Molecular Weight:
266.3162
IUPAC Name:
N-(3-methylsulfanyl-2-oxoazetidin-3-yl)-2-phenoxyacetamide
InChI:
InChI=1S/C12H14N2O3S/c1-18-12(8-13-11(12)16)14-10(15)7-17-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,16)(H,14,15)
InChI Key:
IFLXMMYSGUUVOQ-UHFFFAOYSA-N
SMILES:
CSC1(CNC1=O)NC(=O)COc1ccccc1
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.073g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.315g/mol
Monoisotopic Mass:
266.073g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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