methyl 2-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
methyl 2-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2798-1109 |
| Compound Name: | methyl 2-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
| Molecular Weight: | 387.5 |
| Molecular Formula: | C21 H25 N O4 S |
| Smiles: | CC(C)c1ccc(C)cc1OCC(Nc1c(C(=O)OC)c2CCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1359 |
| logD: | 2.9336 |
| logSw: | -5.083 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.957 |
| InChI Key: | WTUJCYZZHCEQPL-UHFFFAOYSA-N |