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Home > Other Heterocycles > 19158-30-6
19158-30-6 | Morpholine, 4-(7,7-dioxido-8-phenyl-7-thiabicyclo[4.2.0]oct-1-yl)-
CAS No: 19158-30-6 Catalog No: AG002FCI MDL No:
Product Description
Catalog Number:
AG002FCI
Chemical Name:
Morpholine, 4-(7,7-dioxido-8-phenyl-7-thiabicyclo[4.2.0]oct-1-yl)-
CAS Number:
19158-30-6
Molecular Formula:
C17H23NO3S
Molecular Weight:
321.4344
IUPAC Name:
1-morpholin-4-yl-8-phenyl-7λ6-thiabicyclo[4.2.0]octane 7,7-dioxide
InChI:
InChI=1S/C17H23NO3S/c19-22(20)15-8-4-5-9-17(15,18-10-12-21-13-11-18)16(22)14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-13H2
InChI Key:
NMQHAHIFQLFGPR-UHFFFAOYSA-N
SMILES:
O=S1(=O)C2CCCCC2(C1c1ccccc1)N1CCOCC1
NSC Number:
162298
Properties
Complexity:
503
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.14g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.435g/mol
Monoisotopic Mass:
321.14g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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