ethyl 2-({[4-(difluoromethoxy)phenyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-({[4-(difluoromethoxy)phenyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-({[4-(difluoromethoxy)phenyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3335-0818 |
| Compound Name: | ethyl 2-({[4-(difluoromethoxy)phenyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 412.48 |
| Molecular Formula: | C18 H18 F2 N2 O3 S2 |
| Smiles: | [H]C(Oc1ccc(cc1)NC(Nc1c(C(=O)OCC)c2CCCc2s1)=S)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.6584 |
| logD: | 4.249 |
| logSw: | -4.5482 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.501 |
| InChI Key: | YKQITFCVOBSYGK-UHFFFAOYSA-N |