methyl 2-[2-(4-ethylpiperazin-1-yl)acetamido]-4-phenylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(4-ethylpiperazin-1-yl)acetamido]-4-phenylthiophene-3-carboxylate
methyl 2-[2-(4-ethylpiperazin-1-yl)acetamido]-4-phenylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-1870 |
| Compound Name: | methyl 2-[2-(4-ethylpiperazin-1-yl)acetamido]-4-phenylthiophene-3-carboxylate |
| Molecular Weight: | 387.5 |
| Molecular Formula: | C20 H25 N3 O3 S |
| Smiles: | CCN1CCN(CC1)CC(Nc1c(C(=O)OC)c(cs1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9832 |
| logD: | 2.1893 |
| logSw: | -3.2105 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.354 |
| InChI Key: | DHCXGKHUMFVSID-UHFFFAOYSA-N |