methyl 3-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}acetamido)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}acetamido)thiophene-2-carboxylate
methyl 3-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}acetamido)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8016-4418 |
| Compound Name: | methyl 3-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}acetamido)thiophene-2-carboxylate |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | COC(c1c(ccs1)NC(CN1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2948 |
| logD: | 1.4631 |
| logSw: | -2.9766 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.271 |
| InChI Key: | MVWJVKHEARRMMP-UHFFFAOYSA-N |