N-Boc-2-(phenylsulfonyl)ethanamine - CAS 367932-20-5
Catalog: |
BB023079 |
Product Name: |
N-Boc-2-(phenylsulfonyl)ethanamine |
CAS: |
367932-20-5 |
Synonyms: |
N-[2-(benzenesulfonyl)ethyl]carbamic acid tert-butyl ester; tert-butyl N-[2-(benzenesulfonyl)ethyl]carbamate |
IUPAC Name: | tert-butyl N-[2-(benzenesulfonyl)ethyl]carbamate |
Description: | N-Boc-2-(phenylsulfonyl)ethanamine (CAS# 367932-20-5 ) is a useful research chemical. |
Molecular Weight: | 285.36 |
Molecular Formula: | C13H19NO4S |
Canonical SMILES: | CC(C)(C)OC(=O)NCCS(=O)(=O)C1=CC=CC=C1 |
InChI: | InChI=1S/C13H19NO4S/c1-13(2,3)18-12(15)14-9-10-19(16,17)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,14,15) |
InChI Key: | AQOSMGNZKRYVQH-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-3150586-A1 | Modulators of pharmacokinetic properties of therapeutics | 20070223 |
EP-3689353-A1 | Modulators of pharmacokinetic properties of therapeutics | 20070223 |
EP-3112355-B1 | Modulators of pharmacokinetic properties of therapeutics | 20060707 |
EP-3696171-A1 | Modulators of pharmacokinetic properties of therapeutics | 20060707 |
AU-2004290666-A1 | N-acylsulfonamide apoptosis promoters | 20031113 |
Complexity: | 386 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 285.10347926 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 285.10347926 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 80.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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