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Home > Imidazoles > 338777-60-9
338777-60-9 | 3-(2-hydroxy-1-phenylethyl)-2-sulfanylideneimidazolidin-4-one
CAS No: 338777-60-9 Catalog No: AG00IUEK MDL No:MFCD01316095
Product Description
Catalog Number:
AG00IUEK
Chemical Name:
3-(2-hydroxy-1-phenylethyl)-2-sulfanylideneimidazolidin-4-one
CAS Number:
338777-60-9
Molecular Formula:
C11H12N2O2S
Molecular Weight:
236.2902
MDL Number:
MFCD01316095
IUPAC Name:
3-(2-hydroxy-1-phenylethyl)-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C11H12N2O2S/c14-7-9(8-4-2-1-3-5-8)13-10(15)6-12-11(13)16/h1-5,9,14H,6-7H2,(H,12,16)
InChI Key:
FURQFDBXKBROJI-UHFFFAOYSA-N
SMILES:
OCC(N1C(=S)NCC1=O)c1ccccc1
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.062g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.289g/mol
Monoisotopic Mass:
236.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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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