3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-(((4-methylphenyl)sulfonyl)oxy)pyrido(2,3-d)pyrimidine-2,4,7(1H,3H,8H)-trione
Grundinformationen
- CAS
871700-32-2- Standard-SMILES
Cc1ccc(S(=O)(=O)Oc2c(C)c(=O)n(C)c3c2c(=O)n(C2CC2)c(=O)n3-c2ccc(I)cc2F)cc1- InChIKey
RCCOZJPSLZNDFV-UHFFFAOYSA-N- Summenformel
- C25H21FIN3O6S
- Durchschnittliche Molmasse
- 637,4 g/mol
Namen und Bezeichner
- Bevorzugter Name
- 3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-(((4-methylphenyl)sulfonyl)oxy)pyrido(2,3-d)pyrimidine-2,4,7(1H,3H,8H)-trione
- IUPAC
- [3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxopyrido[2,3-d]pyrimidin-5-yl] 4-methylbenzenesulfonate
- Englischer Name
- 3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-diMethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyriMidin-5-yl 4-Methylbenzenesulfonate
- Summenformel
- C25H21FIN3O6S
- Molmasse
- 637.42
Namen und Synonyme
871700-32-2HTS9D7XD8D3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-(((4-methylphenyl)sulfonyl)oxy)pyrido(2,3-d)pyrimidine-2,4,7(1H,3H,8H)-trione3-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-[[(4-methylphenyl)sulfonyl]oxy]pyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trioneRefChem:10676773-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl 4-methylbenzenesulfonateMFCD18207186[3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxopyrido[2,3-d]pyrimidin-5-yl] 4-methylbenzenesulfonatePyrido[2,3-d]pyrimidine-2,4,7(1H,3H,8H)-trione, 3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-5-[[(4-methylphenyl)sulfonyl]oxy]-C25H21FIN3O6STrametinibImpurity13Trametinib Impurity 09
Weitere Namen anzeigen
1044593-Cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-dimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-diMethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-6,8-diMethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyriMidin-5-yl 4-Methylbenzenesulfonate-8
SCHEMBL1419147SCHEMBL30047235RCCOZJPSLZNDFV-UHFFFAOYSA-NCS-M0423AKOS025403887CS-14284DB-241030F11737
Datenbank-Bezeichner
- CAS
871700-32-2- PubChem CID
- 59717044
- UNII
- HTS9D7XD8D
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,6
- Polarare Oberfläche (TPSA)
- 113 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 7
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 37
- Formalladung
- 0
- Komplexität
- 1.190
Physikochemische Eigenschaften
- Siedepunkt
- 658 · 658.0±65.0 °C(Predicted)
- Dichte
- 1.82 · 1.82±0.1 g/cm3(Predicted)
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- -2.61 · -2.61±0.60(Predicted)
Chemie und Industrie
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