Compound Q&A

What are the physical and chemical properties of 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 (CAS: 871700-32-2)?

Answer

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
This compound is crystalline at room temperature with a molecular weight of approximately 602.02 g/mol. It is poorly soluble in water but soluble in organic solvents like DMSO and DMF. Chemically, it is highly reactive, especially towards nucleophiles due to its iodine and fluoro substituents. It exhibits good stability under neutral conditions but should be handled with care under acidic or basic conditions.

About

English 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
Molecular Formula C25H21FIN3O6S
Molecular Weight 637.43 g/mol
SMILES O=S(C1=CC=C(C)C=C1)(OC(C(C(N2C3CC3)=O)=C4N(C5=CC=C(I)C=C5F)C2=O)=C(C)C(N4C)=O)=O
InChIKey RCCOZJPSLZNDFV-UHFFFAOYSA-N
Last Updated: 2025-12-31 06:49

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