(E)-N-(2-Chloro-6-methylphenyl)-3-ethoxyacrylamide - CAS 863127-76-8
Catalog: |
BB037884 |
Product Name: |
(E)-N-(2-Chloro-6-methylphenyl)-3-ethoxyacrylamide |
CAS: |
863127-76-8 |
Synonyms: |
(E)-N-(2-chloro-6-methylphenyl)-3-ethoxy-2-propenamide; (E)-N-(2-chloro-6-methylphenyl)-3-ethoxyprop-2-enamide |
IUPAC Name: | (E)-N-(2-chloro-6-methylphenyl)-3-ethoxyprop-2-enamide |
Description: | (E)-N-(2-Chloro-6-methylphenyl)-3-ethoxyacrylamide (CAS# 863127-76-8) is a reagent used for the preparation of potent and selective anti-tumor drug Dasatinib. |
Molecular Weight: | 239.70 |
Molecular Formula: | C12H14ClNO2 |
Canonical SMILES: | CCOC=CC(=O)NC1=C(C=CC=C1Cl)C |
InChI: | InChI=1S/C12H14ClNO2/c1-3-16-8-7-11(15)14-12-9(2)5-4-6-10(12)13/h4-8H,3H2,1-2H3,(H,14,15)/b8-7+ |
InChI Key: | DBYFNZJHXGNAGW-BQYQJAHWSA-N |
Boiling Point: | 386.5 °C at 760 mmHg |
Density: | 1.197 g/cm3 |
LogP: | 3.21010 |
Publication Number | Title | Priority Date |
CN-109265455-B | Preparation method of dasatinib | 20181109 |
US-10301302-B2 | Crystalline forms of N-(2-chloro-6-methy]phenvn-2-[F6-[4-(2-hvdroxvethvl)-L-piperazin-vil-2-methvil-4-pvrimidinvllaminol-5-thiazolecarboxamide and their process thereof | 20150629 |
US-2018186784-A1 | Crystalline forms of n-(2-chloro-6-methy]phenvn-2-[f6-[4-(2-hvdroxvethvl)-l-piperazin-vil-2-methvil-4-pvrimidinvllaminol-5-thiazolecarboxamide and their process thereof | 20150629 |
WO-2017002131-A1 | Crystalline forms of n-(2-chloro-6-methy]phenvn-2-[f6-[4-(2-hvdroxvethvl)-l- piperazinvil-2-methvl-4-pvrimidinvllaminol-5-thiazolecarboxamide and their process thereof | 20150629 |
US-2018117043-A1 | Use of src protein inhibitor in the manufacture of a medicament for the prophylaxis and/or treatment of alzheimer's disease | 20150624 |
Complexity: | 255 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 239.0713064 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.0713064 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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