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Home > Other Heterocycles > 853751-19-6
853751-19-6 | 1,4-Dioxa-8-azaspiro[4.5]decane, 8-[(4-methylphenyl)sulfonyl]-
CAS No: 853751-19-6 Catalog No: AG00IDNC MDL No:MFCD01252045
Product Description
Catalog Number:
AG00IDNC
Chemical Name:
1,4-Dioxa-8-azaspiro[4.5]decane, 8-[(4-methylphenyl)sulfonyl]-
CAS Number:
853751-19-6
Molecular Formula:
C14H19NO4S
Molecular Weight:
297.3700
MDL Number:
MFCD01252045
IUPAC Name:
8-(4-methylphenyl)sulfonyl-1,4-dioxa-8-azaspiro[4.5]decane
InChI:
InChI=1S/C14H19NO4S/c1-12-2-4-13(5-3-12)20(16,17)15-8-6-14(7-9-15)18-10-11-19-14/h2-5H,6-11H2,1H3
InChI Key:
AIUOOZWKSYNHFG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N1CCC2(CC1)OCCO2
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.103g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.369g/mol
Monoisotopic Mass:
297.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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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