1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl N-{4-[chloro(difluoro)methoxy]phenyl}-N'-ethylcarbamimidothioate
Chemical Structure Depiction of
1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl N-{4-[chloro(difluoro)methoxy]phenyl}-N'-ethylcarbamimidothioate
1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl N-{4-[chloro(difluoro)methoxy]phenyl}-N'-ethylcarbamimidothioate
Compound characteristics
| Compound ID: | 8010-5637 |
| Compound Name: | 1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl N-{4-[chloro(difluoro)methoxy]phenyl}-N'-ethylcarbamimidothioate |
| Molecular Weight: | 579.79 |
| Molecular Formula: | C20 H17 Cl F2 I N3 O3 S |
| Smiles: | CC/N=C(/Nc1ccc(cc1)OC(F)(F)[Cl])SC1CC(N(C1=O)c1ccc(cc1)I)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4467 |
| logD: | 5.4321 |
| logSw: | -5.8619 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.359 |
| InChI Key: | KNNQBDQWPUNFQK-MRXNPFEDSA-N |