4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl 4-fluorobenzoate
Chemical Structure Depiction of
4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl 4-fluorobenzoate
4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl 4-fluorobenzoate
Compound characteristics
| Compound ID: | 3229-2722 |
| Compound Name: | 4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl 4-fluorobenzoate |
| Molecular Weight: | 342.35 |
| Molecular Formula: | C17 H11 F N2 O3 S |
| Smiles: | C(=C1/C(NC(N1)=S)=O)/c1ccc(cc1)OC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8545 |
| logD: | 2.8338 |
| logSw: | -3.5844 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.672 |
| InChI Key: | MPNOFDFKLOZHMX-UHFFFAOYSA-N |