sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 3-Hydroxy-2-[3-hydroxy-4-(pyrrolidin-1-yl)phenyl]-6,7-dimethylchromen-4-one

3-Hydroxy-2-[3-hydroxy-4-(pyrrolidin-1-yl)phenyl]-6,7-dimethylchromen-4-one

CAS No.:
1353224-67-5
Catalog Number:
AG007ZMO
Molecular Formula:
C21H21NO4
Molecular Weight:
351.3957
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$438
- +
1g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG007ZMO
Chemical Name:
3-Hydroxy-2-[3-hydroxy-4-(pyrrolidin-1-yl)phenyl]-6,7-dimethylchromen-4-one
CAS Number:
1353224-67-5
Molecular Formula:
C21H21NO4
Molecular Weight:
351.3957
MDL Number:
MFCD22192467
IUPAC Name:
3-hydroxy-2-(3-hydroxy-4-pyrrolidin-1-ylphenyl)-6,7-dimethylchromen-4-one
InChI:
InChI=1S/C21H21NO4/c1-12-9-15-18(10-13(12)2)26-21(20(25)19(15)24)14-5-6-16(17(23)11-14)22-7-3-4-8-22/h5-6,9-11,23,25H,3-4,7-8H2,1-2H3
InChI Key:
GZBMQCNHVIBXLU-UHFFFAOYSA-N
SMILES:
Oc1cc(ccc1N1CCCC1)c1oc2cc(C)c(cc2c(=O)c1O)C
Properties
Complexity:
583  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.147g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
351.402g/mol
Monoisotopic Mass:
351.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
Chemical modification of the multitarget neuroprotective compound fisetin. Journal of medicinal chemistry 20120112
Properties