Products for Research Use Only
RegisterLogin

4-Hydroxy Omeprazole Preparation Kit

CAT: 0572-TRC-H948860-50MGSize: 50 mgDry Ice: NoHazardous: Yes
Product image 1
1 / 1
CAT#:0572-TRC-H948860-50MGSize:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
301669-82-9
Synonyms
2-[[(6-Methoxy-1H-benzimidazol-2-yl)sulfinyl]methyl]-3,5-dimethyl-4-pyridinol; 4-Pyridinol, 2-[[(5-methoxy-1H-benzimidazol-2-yl)sulfinyl]methyl]-3,5-dimethyl- (9CI); 4-Desmethylomeprazole; 4-Hydroxyomeprazole
Hazard Statement
No Data Available; UN number: UN3316
Smiles
COc1ccc2[nH]c(nc2c1)S(=O)Cc3ncc(C)c(O)c3C
Molecular Formula
C16 H17 N3 O3 S
Molecular Weight
331.39
InChI
InChI=1S/C16H17N3O3S/c1-9-7-17-14(10(2)15(9)20)8-23(21)16-18-12-5-4-11(22-3)6-13(12)19-16/h4-7H,8H2,1-3H3,(H,17,20)(H,18,19)
Additionnal Information
IUPAC name: 2-[(5-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-3,5-dimethylpyridin-4-ol
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2-((6-Methoxy-1H-benzimidazole-2-sulfinyl)methyl)-3,5-dimethylpyridin-4(1H)-one
CAS Number301669-82-9
PubChem CID9840523
IUPAC Name2-[(6-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-3,5-dimethyl-1H-pyridin-4-one
Molecular FormulaC16H17N3O3S
Molecular Weight331.4
XLogP1.5
Topological Polar Surface Area103
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity587
SMILES
CC1=CNC(=C(C1=O)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC
InChI
InChI=1S/C16H17N3O3S/c1-9-7-17-14(10(2)15(9)20)8-23(21)16-18-12-5-4-11(22-3)6-13(12)19-16/h4-7H,8H2,1-3H3,(H,17,20)(H,18,19)
InChIKey
VSOAYQZFYNZNKR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-((6-Methoxy-1H-benzimidazole-2-sulfinyl)methyl)-3,5-dimethylpyridin-4(1H)-one
CAS: 301669-82-9
CID: 9840523
Formula: C16H17N3O3S
MW: 331.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight331.4
XLogP31.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass331.09906259
Monoisotopic Mass331.09906259
Topological Polar Surface Area103 Ų
Heavy Atom Count23
Formal Charge0
Complexity587
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-H948845-25MG4-Hydroxy Omeprazole Sulfide
TRC-H948940-5MG4-Hydroxy Omeprazole Sulfone
TRC-H948940-50MG4-Hydroxy Omeprazole Sulfone
TRC-H948845-10MG4-Hydroxy Omeprazole Sulfide
TRC-H948845-5MG4-Hydroxy Omeprazole Sulfide
TRC-H926301-5MG(R,S)-4-Hydroxy Cyclophosphamide Preparation Kit
TRC-H926302-2.5MG(R,S)-4-Hydroxy Cyclophosphamide-d4 Preparation Kit
TRC-H948868-50MG5-Hydroxy Omeprazole Sulfone
H948115(S)-5-Hydroxy Omeprazole
TRC-H749990-100MG5-Hydroxy Acetate Omeprazole

Alternative Products

CatalogName
0142274-Hydroxy Omeprazole, Preparation Kit (contains 4-Hydroxy Omeprazole Sulfide and m-Chloroperoxybenzoic Acid)
T84954-014-hydroxy Omeprazole sulfide
MBS6074347-014-Hydroxy Omeprazole Sulfone
MBS57984995-hydroxy Omeprazole
AR-O01319-013-Hydroxy Omeprazole
4366545-Hydroxy Acetate Omeprazole
sc-488826(S) -5-Hydroxy Omeprazole
AR-O01370-015-Hydroxy Omeprazole Sulfone
CS-T-562175-Hydroxy Omeprazole-d3
465514-01S-5-Hydroxy Omeprazole

Popular Products