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26475-66-1 | Thiomorpholine, 4-(phenylmethyl)-, 1,1-dioxide
CAS No: 26475-66-1 Catalog No: AG002TDR MDL No:MFCD00084894
Product Description
Catalog Number:
AG002TDR
Chemical Name:
Thiomorpholine, 4-(phenylmethyl)-, 1,1-dioxide
CAS Number:
26475-66-1
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
MDL Number:
MFCD00084894
IUPAC Name:
4-benzyl-1,4-thiazinane 1,1-dioxide
InChI:
InChI=1S/C11H15NO2S/c13-15(14)8-6-12(7-9-15)10-11-4-2-1-3-5-11/h1-5H,6-10H2
InChI Key:
KFAMTQFKYUXQKV-UHFFFAOYSA-N
SMILES:
O=S1(=O)CCN(CC1)Cc1ccccc1
NSC Number:
255018
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.082g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.306g/mol
Monoisotopic Mass:
225.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| 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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