Home Hydroxyls 1-[4-(4-Chlorophenyl)-2-hydroxylbutyl]imidazole

1-[4-(4-Chlorophenyl)-2-hydroxylbutyl]imidazole

CAS No.:
67085-11-4
Catalog Number:
AG00F9YS
Molecular Formula:
C13H15ClN2O
Molecular Weight:
250.7240
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Product Description
Catalog Number:
AG00F9YS
Chemical Name:
1-[4-(4-Chlorophenyl)-2-hydroxylbutyl]imidazole
CAS Number:
67085-11-4
Molecular Formula:
C13H15ClN2O
Molecular Weight:
250.7240
MDL Number:
MFCD09751154
IUPAC Name:
4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-ol
InChI:
InChI=1S/C13H15ClN2O/c14-12-4-1-11(2-5-12)3-6-13(17)9-16-8-7-15-10-16/h1-2,4-5,7-8,10,13,17H,3,6,9H2
InChI Key:
YAHZVMVZBIMHGM-UHFFFAOYSA-N
SMILES:
OC(Cn1cncc1)CCc1ccc(cc1)Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.087g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.726g/mol
Monoisotopic Mass:
250.087g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Recombinant truncated and microsomal heme oxygenase-1 and -2: differential sensitivity to inhibitors. Canadian journal of physiology and pharmacology 20100401
Properties