ethyl 2-(2,4-dinitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2,4-dinitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-(2,4-dinitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3237-0558 |
| Compound Name: | ethyl 2-(2,4-dinitrobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 405.38 |
| Molecular Formula: | C17 H15 N3 O7 S |
| Smiles: | CCOC(c1c2CCCc2sc1NC(c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5227 |
| logD: | -2.7539 |
| logSw: | -4.2623 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.626 |
| InChI Key: | NKLOEXVMHMCGID-UHFFFAOYSA-N |