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73696-35-2 | 4H-[1]Benzothieno[2,3-d][1,3]oxazin-4-one,5,6,7,8-tetrahydro-2-phenyl-
CAS No: 73696-35-2 Catalog No: AG005BYV MDL No:
Product Description
Catalog Number:
AG005BYV
Chemical Name:
4H-[1]Benzothieno[2,3-d][1,3]oxazin-4-one,5,6,7,8-tetrahydro-2-phenyl-
CAS Number:
73696-35-2
Molecular Formula:
C4H3NO2
Molecular Weight:
97.0721
IUPAC Name:
2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]oxazin-4-one
InChI:
InChI=1S/C16H13NO2S/c18-16-13-11-8-4-5-9-12(11)20-15(13)17-14(19-16)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChI Key:
WCCHLKANERBZME-UHFFFAOYSA-N
SMILES:
O=c1cconc1
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.067g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.345g/mol
Monoisotopic Mass:
283.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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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