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161185-27-9 | 6-butyl-4-hydroxy-2H,5H,6H-pyrano[3,2-c]quinoline-2,5-dione
CAS No: 161185-27-9 Catalog No: AG00IW5V MDL No:MFCD00831682
Product Description
Catalog Number:
AG00IW5V
Chemical Name:
6-butyl-4-hydroxy-2H,5H,6H-pyrano[3,2-c]quinoline-2,5-dione
CAS Number:
161185-27-9
Molecular Formula:
C16H15NO4
Molecular Weight:
285.2946
MDL Number:
MFCD00831682
IUPAC Name:
6-butyl-4-hydroxypyrano[3,2-c]quinoline-2,5-dione
InChI:
InChI=1S/C16H15NO4/c1-2-3-8-17-11-7-5-4-6-10(11)15-14(16(17)20)12(18)9-13(19)21-15/h4-7,9,18H,2-3,8H2,1H3
InChI Key:
WMBIIJONDDZXMP-UHFFFAOYSA-N
SMILES:
CCCCn1c2ccccc2c2c(c1=O)c(O)cc(=O)o2
Properties
Complexity:
534
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.1g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.299g/mol
Monoisotopic Mass:
285.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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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