TMX-2138
HIT219250800
sdf文件结构编辑类似物检索
HIT ID: HIT219250800
Cas No: 2488892-07-3
分子式: C40H43BrFN9O11S
分子量: 956.8
常用名: TMX-2138
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-{[5-bromo-2-({4-[(14-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}-3,6,9,12-tetraoxatetradecan-1-yl)sulfamoyl]phenyl}amino)pyrimidin-4-yl]amino}-6-fluorobenzamide
IUPAC: 2-{[5-bromo-2-({4-[(14-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}-3,6,9,12-tetraoxatetradecan-1-yl)sulfamoyl]phenyl}amino)pyrimidin-4-yl]amino}-6-fluorobenzamide
SMILES: NC(=O)c1c(F)cccc1Nc1nc(Nc2ccc(cc2)S(=O)(=O)NCCOCCOCCOCCOCCNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)ncc1Br
SMILES: NC(=O)c1c(F)cccc1Nc1nc(Nc2ccc(cc2)S(=O)(=O)NCCOCCOCCOCCOCCNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)ncc1Br
InChI key: FCFITSHNFYGDJJ-UHFFFAOYSA-N
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