propan-2-yl 2-(4-methoxy-3-nitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-(4-methoxy-3-nitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
propan-2-yl 2-(4-methoxy-3-nitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-0578 |
| Compound Name: | propan-2-yl 2-(4-methoxy-3-nitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C19 H20 N2 O6 S |
| Smiles: | CC(C)OC(c1c2CCCc2sc1NC(c1ccc(c(c1)[N+]([O-])=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7382 |
| logD: | -0.7514 |
| logSw: | -4.3797 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.554 |
| InChI Key: | STOJFCYLOAPAMD-UHFFFAOYSA-N |