Home Other Building Blocks Helioxanthin derivative 5-4-2

Helioxanthin derivative 5-4-2

CAS No.:
203935-39-1
Catalog Number:
AG00BF3K
Molecular Formula:
C20H13NO5
Molecular Weight:
347.3209
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$640
- +
10mg
99%
1 week
United States
$890
- +
Product Description
Catalog Number:
AG00BF3K
Chemical Name:
Helioxanthin derivative 5-4-2
CAS Number:
203935-39-1
Molecular Formula:
C20H13NO5
Molecular Weight:
347.3209
MDL Number:
MFCD28167791
IUPAC Name:
10-(1,3-benzodioxol-5-yl)-8,9-dihydro-[1,3]benzodioxolo[7,6-f]isoindol-7-one
InChI:
InChI=1S/C20H13NO5/c22-20-12-5-10-2-4-15-19(26-9-24-15)18(10)17(13(12)7-21-20)11-1-3-14-16(6-11)25-8-23-14/h1-6H,7-9H2,(H,21,22)
InChI Key:
UVKXTQRJKHBAMT-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1cc1ccc3c(c1c2c1ccc2c(c1)OCO2)OCO3
Properties
Complexity:
585  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.079g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
347.326g/mol
Monoisotopic Mass:
347.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
Synthesis and antiviral activity of helioxanthin analogues. Journal of medicinal chemistry 20050127
Properties