N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-propoxybenzamide
Chemical Structure Depiction of
N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-propoxybenzamide
N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-propoxybenzamide
Compound characteristics
| Compound ID: | D457-0289 |
| Compound Name: | N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-propoxybenzamide |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | [H]N(C(c1cccc(c1)OCCC)=O)c1nc(c2ccc(c(c2)OC)OCC)ns1 |
| Stereo: | ACHIRAL |
| logP: | 5.0394 |
| logD: | 5.0381 |
| logSw: | -4.6642 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.176 |
| InChI Key: | PCJQOVOSZRFCHV-UHFFFAOYSA-N |