Basic information
- CAS
361162-95-0- Standard SMILES
CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1N- InChIKey
AIQFOGOHLOICRK-UHFFFAOYSA-N- Molecular formula
- C18H14ClFN4O
- Average molar mass
- 356.8 g/mol
- Monoisotopic mass
- 356.0840169
Names & identifiers
- Preferred name
- 6-Amino-4-(3-chloro-4-fluoroanilino)-3-cyano-7-ethyloxyquinoline
- IUPAC
- 6-amino-4-(3-chloro-4-fluoroanilino)-7-ethoxyquinoline-3-carbonitrile
- English name
- 6-amino-4-(3-chloro-4-fluorophenylamino)-7-ethoxyquinoline-3-carbonitrile
- Molecular formula
- C18H14ClFN4O
- Molecular weight
- 356.78
Names & synonyms
361162-95-06-Amino-4-(3-chloro-4-fluoroanilino)-3-cyano-7-ethyloxyquinoline6-Amino-4-((3-chloro-4-fluorophenyl)amino)-7-ethoxyquinoline-3-carbonitrile6-amino-4-(3-chloro-4-fluoroanilino)-7-ethoxyquinoline-3-carbonitrile3-Quinolinecarbonitrile, 6-amino-4-[(3-chloro-4-fluorophenyl)amino]-7-ethoxy-6-AMINO-4-[(3-CHLORO-4-FLUOROPHENYL)AMINO]-7-ETHOXYQUINOLINE-3-CARBONITRILEAIQFOGOHLOICRK-UHFFFAOYSA-N6-Amino-4-[(3-chloro-4-fluorophenyl)amino]-7-ethoxy-3-quinolinecarbonitrile; 6-Amino-4-(3-chloro-4-fluorophenylamino)-7-ethoxy-quinoline-3-carbonitrile;6-Amino-4-(3-chloro-4-fluorophenylamino)-7-ethoxy-quinoline-3-carbonitrileMFCD09284738orb3135701SCHEMBL2574073
Show more names
DH036-amino-4-[(3-chloro-4-fluorophenyl)amino]-7-ethoxyquinoline...6-amino-4-(3-chloro-4-fluorophenylamino)-7-ethoxyquinoline-3-carbonitrile6-AMino-4-[(3-chloro-4-fluorophenyl)aMino]-7-ethoxy-3-quinolinecarbonitrile
CHEMBL4578340DTXSID40452807AKOS025149690CCG-357873SB72814AC-26217DB-296477CS-0001860
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 501
Physicochemical properties
- Melting point
- 181 · 181 - 183°C (dec.)
- storage temp.
- Refrigerator
- solubility
- DMSO (Sparingly), Methanol (Slightly)
- form
- Solid
- color
- Light Orange to Dark Yellow
Chemistry & industry
Applications
UsesIntermediate in the preparation of Tyrosine Kinase Inhibitors.
Suppliers17 total
Nanjing Fred Technology Co., Ltd+86-25-84696168 +86-15380713688 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海源鼎化学科技有限公司21-57721279 18121011378 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
深圳菲斯生物科技有限公司0755-83725681-603
泰州同新生物医药科技有限公司0523-86818997 18652728585 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
湖北康鑫源顺医药化工有限公司027-51831887 15337167856 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392
Related reactions
9 records
Compound notes
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