Home Other Building Blocks UNC0379 (trifluoroacetate)

UNC0379 (trifluoroacetate)

CAS No.:
1620401-83-3
Catalog Number:
AG00ABPC
Molecular Formula:
C25H36F3N5O4
Molecular Weight:
527.5796
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
2mg
99%
1 week
United States
$168
- +
5mg
99%
1 week
United States
$223
- +
Product Description
Catalog Number:
AG00ABPC
Chemical Name:
UNC0379 (trifluoroacetate)
CAS Number:
1620401-83-3
Molecular Formula:
C25H36F3N5O4
Molecular Weight:
527.5796
MDL Number:
MFCD28385863
IUPAC Name:
6,7-dimethoxy-2-pyrrolidin-1-yl-N-(5-pyrrolidin-1-ylpentyl)quinazolin-4-amine;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C23H35N5O2.C2HF3O2/c1-29-20-16-18-19(17-21(20)30-2)25-23(28-14-8-9-15-28)26-22(18)24-10-4-3-5-11-27-12-6-7-13-27;3-2(4,5)1(6)7/h16-17H,3-15H2,1-2H3,(H,24,25,26);(H,6,7)
InChI Key:
NRGGPYZTHNAVFM-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.COc1cc2c(NCCCCCN3CCCC3)nc(nc2cc1OC)N1CCCC1
Properties
Complexity:
581  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
527.272g/mol
Formal Charge:
0
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
527.589g/mol
Monoisotopic Mass:
527.272g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties