Home Halogens (S)-6-(5-(7-bromo-9,9-difluoro-9H-fluoren-2-yl)-1H-imidazol-2-yl)-5-azaspiro[2.4]heptane hydrochloride

(S)-6-(5-(7-bromo-9,9-difluoro-9H-fluoren-2-yl)-1H-imidazol-2-yl)-5-azaspiro[2.4]heptane hydrochloride

CAS No.:
2004675-25-4
Catalog Number:
AG01D906
Molecular Formula:
C22H19BrClF2N3
Molecular Weight:
478.7602
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Product Description
Catalog Number:
AG01D906
Chemical Name:
(S)-6-(5-(7-bromo-9,9-difluoro-9H-fluoren-2-yl)-1H-imidazol-2-yl)-5-azaspiro[2.4]heptane hydrochloride
CAS Number:
2004675-25-4
Molecular Formula:
C22H19BrClF2N3
Molecular Weight:
478.7602
MDL Number:
MFCD28347555
IUPAC Name:
(6S)-6-[5-(7-bromo-9,9-difluorofluoren-2-yl)-1H-imidazol-2-yl]-5-azaspiro[2.4]heptane;hydrochloride
InChI:
InChI=1S/C22H18BrF2N3.ClH/c23-13-2-4-15-14-3-1-12(7-16(14)22(24,25)17(15)8-13)19-10-26-20(28-19)18-9-21(5-6-21)11-27-18;/h1-4,7-8,10,18,27H,5-6,9,11H2,(H,26,28);1H/t18-;/m0./s1
InChI Key:
YLBUHBAYGDRWEI-FERBBOLQSA-N
SMILES:
Brc1ccc2c(c1)C(F)(F)c1c2ccc(c1)c1cnc([nH]1)[C@H]1NCC2(C1)CC2.Cl
Properties
Complexity:
627  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
477.042g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
478.766g/mol
Monoisotopic Mass:
477.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties