HIT ID: HIT212668437
Cas No: 2093387-50-7
分子式: C19H21F3N4O6
分子量: 458.394
常用名: Thalidomide-NH-C4-NH2 TFA
氢键受体数 (HBA): 6
氢键供体数 (HBD): 3
LogP: -0.24279405
IUPAC: 4-[(4-aminobutyl)amino]-2-(2,6-dioxopiperidin-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione; trifluoroacetic acid
IUPAC: 4-[(4-aminobutyl)amino]-2-(2,6-dioxopiperidin-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione; trifluoroacetic acid
SMILES: OC(=O)C(F)(F)F.NCCCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12
SMILES: OC(=O)C(F)(F)F.NCCCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12
InChI key: UEWVCAGWITUEQS-UHFFFAOYSA-N