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53052-06-5 | OXAZOLO[4,5-B]PYRIDIN-2(3H)THIONE
CAS No: 53052-06-5 Catalog No: AG00DDXC MDL No:MFCD01089040
Product Description
Catalog Number:
AG00DDXC
Chemical Name:
OXAZOLO[4,5-B]PYRIDIN-2(3H)THIONE
CAS Number:
53052-06-5
Molecular Formula:
C6H4N2OS
Molecular Weight:
152.1738
MDL Number:
MFCD01089040
IUPAC Name:
3H-[1,3]oxazolo[4,5-b]pyridine-2-thione
InChI:
InChI=1S/C6H4N2OS/c10-6-8-5-4(9-6)2-1-3-7-5/h1-3H,(H,7,8,10)
InChI Key:
BRSZJWYJYOGBGK-UHFFFAOYSA-N
SMILES:
S=c1oc2c([nH]1)nccc2
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.004g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.171g/mol
Monoisotopic Mass:
152.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
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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