Fluorine F 18 Dasatinib
基本情報
- CAS
957218-03-0- 標準SMILES
Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CC[18F])CC2)n1- InChIKey
PLZOWXHKTJJSQR-MIGPCILRSA-N- 分子式
- C22H25ClFN7OS
- 平均分子量
- 489 g/mol
- 単同位体質量
- 488.15392
概要
Fluorine F 18 Dasatinib is a radioconjugate composed of a derivative of the multi-targeted kinase inhibitor dasatinib conjugated to the radioisotope fluorine F 18, with potential imaging activity during positron emission tomography (PET). Upon administration of fluorine F 18 dasatinib, dasatinib targets and binds to Bcr/Abl, SRC-family protein-tyrosine kinases, c-Kit and platelet-derived growth factor receptor (PDGFR). Upon binding, the fluorine F 18 moiety allows PET imaging of tumor cells and can be used as a tracer for the biodistribution of dasatinib.
名称と識別子
- 優先名称
- Fluorine F 18 Dasatinib
- IUPAC
- N-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-(18F)fluoroethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide
名称と別名
18F-DasatinibFLUORO-DASATINIB F-18[18F]-N-(2-Chloro-6-methylphenyl)-2-(6-(4-(2-fluoroethyl)piperazin-1-yl)-2-methylpyrimidin-4-ylamino)thiazole-5-carboxamide18F-SKI-249380SKI-249380 F-18(18F)-N-(2-Chloro-6-methylphenyl)-2-(6-(4-(2-fluoroethyl)piperazin-1-yl)-2-methylpyrimidin-4-ylamino)thiazole-5-carboxamide5-THIAZOLECARBOXAMIDE, N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(4-(2-(FLUORO-18F)ETHYL)-1-PIPERAZINYL)-2-METHYL-4-PYRIMIDINYL)AMINO)-RefChem:200985Fluorine F 18 DasatinibUNII-KD0C0X4Y6EF-SKI24938018F-SKI 249380
名称をさらに表示
(18F)SKI 249380(18F)-SKI-249380957218-03-0N-(2-Chloro-6-methylphenyl)-2-[[6-[4-(2-(18F)fluoranylethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamideKD0C0X4Y6EFLUORO(F18)-DASATINIBCHEMBL391226SCHEMBL13164780
データベース識別子
- CAS
957218-03-0- PubChem CID
- 23657440
- ChEMBL
CHEMBL391226
物性
構造計算による物性
- XLogP
- 4.6
- 極性表面積
- 115 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 9
- 回転可能結合数
- 7
- 重原子数
- 33
- 形式電荷
- 0
- 複雑度
- 644
関連反応
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