Home Other Building Blocks Ethylenedioxy Spiperone

Ethylenedioxy Spiperone

CAS No.:
54080-21-6
Catalog Number:
AG00DDGW
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DDGW
Chemical Name:
Ethylenedioxy Spiperone
CAS Number:
54080-21-6
MDL Number:
MFCD01679400
IUPAC Name:
8-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
InChI:
InChI=1S/C25H30FN3O3/c26-21-9-7-20(8-10-21)25(31-17-18-32-25)11-4-14-28-15-12-24(13-16-28)23(30)27-19-29(24)22-5-2-1-3-6-22/h1-3,5-10H,4,11-19H2,(H,27,30)
InChI Key:
SFQUTTGZLHJZLP-UHFFFAOYSA-N
Properties
Complexity:
634  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
439.227g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
439.531g/mol
Monoisotopic Mass:
439.227g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties