N-(1-Boc-azetidin-3-ylidene)-2-methylpropane-2-sulfinamide - CAS 1291487-32-5
Catalog: |
BB006972 |
Product Name: |
N-(1-Boc-azetidin-3-ylidene)-2-methylpropane-2-sulfinamide |
CAS: |
1291487-32-5 |
Synonyms: |
3-tert-butylsulfinylimino-1-azetidinecarboxylic acid tert-butyl ester; tert-butyl 3-tert-butylsulfinyliminoazetidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-tert-butylsulfinyliminoazetidine-1-carboxylate |
Description: | N-(1-Boc-azetidin-3-ylidene)-2-methylpropane-2-sulfinamide (CAS# 1291487-32-5) is a useful research chemical. |
Molecular Weight: | 274.38 |
Molecular Formula: | C12H22N2O3S |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC(=NS(=O)C(C)(C)C)C1 |
InChI: | InChI=1S/C12H22N2O3S/c1-11(2,3)17-10(15)14-7-9(8-14)13-18(16)12(4,5)6/h7-8H2,1-6H3 |
InChI Key: | JOBIXWHPZPUSTM-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
MDL: | MFCD18839250 |
LogP: | 2.94390 |
Publication Number | Title | Priority Date |
CN-111423434-A | Carbonamide derivative and preparation method thereof | 20190109 |
EP-2831066-A1 | Benzofuran derivatives for the treatment of hepatitis c | 20120327 |
EP-2831066-B1 | Benzofuran derivatives for the treatment of hepatitis c | 20120327 |
US-2015141395-A1 | Benzofuran derivatives for the treatment of hepatitis c | 20120327 |
US-9096580-B2 | Benzofuran derivatives for the treatment of hepatitis C | 20120327 |
Complexity: | 383 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 274.13511374 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 274.13511374 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 78.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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