Methyl 3-(Methylsulfonamido)thiophene-2-carboxylate - CAS 79128-71-5
Catalog: |
BB036295 |
Product Name: |
Methyl 3-(Methylsulfonamido)thiophene-2-carboxylate |
CAS: |
79128-71-5 |
Synonyms: |
3-(methanesulfonamido)-2-thiophenecarboxylic acid methyl ester; methyl 3-(methanesulfonamido)thiophene-2-carboxylate |
IUPAC Name: | methyl 3-(methanesulfonamido)thiophene-2-carboxylate |
Description: | Methyl 3-(Methylsulfonamido)thiophene-2-carboxylate (CAS# 79128-71-5) is a useful research chemical. |
Molecular Weight: | 235.28 |
Molecular Formula: | C7H9NO4S2 |
Canonical SMILES: | COC(=O)C1=C(C=CS1)NS(=O)(=O)C |
InChI: | InChI=1S/C7H9NO4S2/c1-12-7(9)6-5(3-4-13-6)8-14(2,10)11/h3-4,8H,1-2H3 |
InChI Key: | JDRDODRTERMXSR-UHFFFAOYSA-N |
LogP: | 2.06000 |
Publication Number | Title | Priority Date |
CA-2875421-A1 | Derivatives of 1-phenyl-2-pyridinyl alkyl alcohols as phosphodiesterase inhibitors | 20120604 |
EP-2855450-A1 | Derivatives of 1-phenyl-2-pyridinyl alkyl alcohols as phosphodiesterase inhibitors | 20120604 |
EP-2855450-B1 | Derivatives of 1-phenyl-2-pyridinyl alkyl alcohols as phosphodiesterase inhibitors | 20120604 |
KR-20150022789-A | Derivatives of 1-phenyl-2-pyridinyl alkyl alcohols as phosphodiesterase inhibitors | 20120604 |
RU-2637945-C2 | Derivatives of 1-phenyl-2-pyridinyl-alkyl alcohols as phosphodiesterase inhibitors | 20120604 |
Complexity: | 308 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 234.99730012 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 234.99730012 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 109 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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