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Home > Quinoline > 380633-63-6
380633-63-6 | 4-hydroxy-6-(propan-2-yl)-2H,5H,6H-pyrano[3,2-c]quinoline-2,5-dione
CAS No: 380633-63-6 Catalog No: AG00IZ1Y MDL No:MFCD03230530
Product Description
Catalog Number:
AG00IZ1Y
Chemical Name:
4-hydroxy-6-(propan-2-yl)-2H,5H,6H-pyrano[3,2-c]quinoline-2,5-dione
CAS Number:
380633-63-6
Molecular Formula:
C15H13NO4
Molecular Weight:
271.2680
MDL Number:
MFCD03230530
IUPAC Name:
4-hydroxy-6-propan-2-ylpyrano[3,2-c]quinoline-2,5-dione
InChI:
InChI=1S/C15H13NO4/c1-8(2)16-10-6-4-3-5-9(10)14-13(15(16)19)11(17)7-12(18)20-14/h3-8,17H,1-2H3
InChI Key:
PBBMHDQZZBVLCA-UHFFFAOYSA-N
SMILES:
O=c1cc(O)c2c(o1)c1ccccc1n(c2=O)C(C)C
Properties
Complexity:
532
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.084g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.272g/mol
Monoisotopic Mass:
271.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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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