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Tamsulosin Diether

CAT: 0572-TRC-T002340-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-T002340-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
858583-34-3
Hazard Statement
No Data Available
Smiles
CCOc1ccccc1OCCN[C@H](C)Cc2ccc(OC)c(c2)S(=O)(=O)NCCOc3ccccc3OCC
Molecular Formula
C30 H40 N2 O7 S
Molecular Weight
572.713
InChI
InChI=1S/C30H40N2O7S/c1-5-36-25-11-7-9-13-27(25)38-19-17-31-23(3)21-24-15-16-29(35-4)30(22-24)40(33,34)32-18-20-39-28-14-10-8-12-26(28)37-6-2/h7-16,22-23,31-32H,5-6,17-21H2,1-4H3/t23-/m1/s1
Additionnal Information
IUPAC name: N-[2-(2-ethoxyphenoxy)ethyl]-5-[(2R)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide
Shipping Conditions
Room Temperature

Chemical Information

Tamsulosin Diether
CAS Number858583-34-3
PubChem CID169446680
IUPAC NameN-[2-(2-ethoxyphenoxy)ethyl]-5-[(2R)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide
Molecular FormulaC30H40N2O7S
Molecular Weight572.7
XLogP5.1
Topological Polar Surface Area113
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count18
Heavy Atom Count40
Formal Charge0
Complexity781
SMILES
CCOC1=CC=CC=C1OCCN[C@H](C)CC2=CC(=C(C=C2)OC)S(=O)(=O)NCCOC3=CC=CC=C3OCC
InChI
InChI=1S/C30H40N2O7S/c1-5-36-25-11-7-9-13-27(25)38-19-17-31-23(3)21-24-15-16-29(35-4)30(22-24)40(33,34)32-18-20-39-28-14-10-8-12-26(28)37-6-2/h7-16,22-23,31-32H,5-6,17-21H2,1-4H3/t23-/m1/s1
InChIKey
SGIAOUHMDMJRHA-HSZRJFAPSA-N
Chemical Structure
2D Structure
2D structure of Tamsulosin Diether
CAS: 858583-34-3
CID: 169446680
Formula: C30H40N2O7S
MW: 572.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight572.7
XLogP35.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count18
Exact Mass572.25562279
Monoisotopic Mass572.25562279
Topological Polar Surface Area113 Ų
Heavy Atom Count40
Formal Charge0
Complexity781
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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