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Home > Imidazoles > 853723-93-0
853723-93-0 | 3-Cycloheptyl-2-mercapto-3,5-dihydro-4h-imidazol-4-one
CAS No: 853723-93-0 Catalog No: AG00IDN6 MDL No:MFCD06655868
Product Description
Catalog Number:
AG00IDN6
Chemical Name:
3-Cycloheptyl-2-mercapto-3,5-dihydro-4h-imidazol-4-one
CAS Number:
853723-93-0
Molecular Formula:
C10H16N2OS
Molecular Weight:
212.3118
MDL Number:
MFCD06655868
IUPAC Name:
3-cycloheptyl-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C10H16N2OS/c13-9-7-11-10(14)12(9)8-5-3-1-2-4-6-8/h8H,1-7H2,(H,11,14)
InChI Key:
ARZACXDVVFUVMX-UHFFFAOYSA-N
SMILES:
O=C1CN=C(N1C1CCCCCC1)S
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.098g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.311g/mol
Monoisotopic Mass:
212.098g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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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