Home Halogens (S)-4-(4-bromophenyl)-2-(pyrrolidin-2-yl)-1H-imidazole hydrochloride

(S)-4-(4-bromophenyl)-2-(pyrrolidin-2-yl)-1H-imidazole hydrochloride

CAS No.:
1272654-85-9
Catalog Number:
AG01DK3O
Molecular Formula:
C13H15BrClN3
Molecular Weight:
328.6353
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Product Description
Catalog Number:
AG01DK3O
Chemical Name:
(S)-4-(4-bromophenyl)-2-(pyrrolidin-2-yl)-1H-imidazole hydrochloride
CAS Number:
1272654-85-9
Molecular Formula:
C13H15BrClN3
Molecular Weight:
328.6353
MDL Number:
MFCD31555361
IUPAC Name:
5-(4-bromophenyl)-2-[(2S)-pyrrolidin-2-yl]-1H-imidazole;hydrochloride
InChI:
InChI=1S/C13H14BrN3.ClH/c14-10-5-3-9(4-6-10)12-8-16-13(17-12)11-2-1-7-15-11;/h3-6,8,11,15H,1-2,7H2,(H,16,17);1H/t11-;/m0./s1
InChI Key:
BWELXHOHVMRNCH-MERQFXBCSA-N
SMILES:
Brc1ccc(cc1)c1c[nH]c(n1)[C@@H]1CCCN1.Cl
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
327.014g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
328.638g/mol
Monoisotopic Mass:
327.014g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties