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Home > Other Heterocycles > 1731-61-9

1731-61-9

1731-61-9 | Morpholine, 4-(7,7-dioxido-7-thiabicyclo[4.2.0]oct-1-yl)-

CAS No: 1731-61-9 Catalog No: AG001YM2 MDL No:

Product Description

Catalog Number:
AG001YM2
Chemical Name:
Morpholine, 4-(7,7-dioxido-7-thiabicyclo[4.2.0]oct-1-yl)-
CAS Number:
1731-61-9
Molecular Formula:
C11H19NO3S
Molecular Weight:
245.3385
IUPAC Name:
1-morpholin-4-yl-7λ6-thiabicyclo[4.2.0]octane 7,7-dioxide
InChI:
InChI=1S/C11H19NO3S/c13-16(14)9-11(4-2-1-3-10(11)16)12-5-7-15-8-6-12/h10H,1-9H2
InChI Key:
SDSJLPWJNCDWMK-UHFFFAOYSA-N
SMILES:
O=S1(=O)CC2(C1CCCC2)N1CCOCC1

Properties

Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.109g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.337g/mol
Monoisotopic Mass:
245.109g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

Literature

Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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