2-(Benzhydrylthio)acetamide - CAS 68524-30-1
Catalog: |
BB033574 |
Product Name: |
2-(Benzhydrylthio)acetamide |
CAS: |
68524-30-1 |
Synonyms: |
2-[(diphenylmethyl)thio]acetamide; 2-benzhydrylsulfanylacetamide |
IUPAC Name: | 2-benzhydrylsulfanylacetamide |
Description: | 2-(Benzhydrylthio)acetamide (CAS# 68524-30-1) is an analogue and precursor to Modafinil (M482500), an α-1-adrenergic agonist. Modafinil is a CNS stimulant; psychostimulant that displays neuroprotective and antiparkinsonian activity in a primate model of Parkinson's disease. |
Molecular Weight: | 257.35 |
Molecular Formula: | C15H15NOS |
Canonical SMILES: | C1=CC=C(C=C1)C(C2=CC=CC=C2)SCC(=O)N |
InChI: | InChI=1S/C15H15NOS/c16-14(17)11-18-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17) |
InChI Key: | HCRQRIFRHGPWBH-UHFFFAOYSA-N |
Boiling Point: | 427.707 °C at 760 mmHg |
Density: | 1.184 g/cm3 |
MDL: | MFCD00876107 |
LogP: | 3.69480 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P273, P301+P312, P330, P391, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2019105646-A1 | Ion pair catalysis of tungstate and molybdate | 20160322 |
WO-2017164813-A1 | Ion pair catalysis of tungstate and molybdate | 20160322 |
US-10710061-B2 | Ion pair catalysis of tungstate and molybdate | 20160322 |
CA-2989243-A1 | Heterocyclic compounds with working memory enhancing activity | 20140813 |
EP-2985279-A1 | Heterocyclic compounds with working memory enhancing activity | 20140813 |
Complexity: | 239 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.08743528 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.08743528 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 68.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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