ethyl N-({2-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]ethyl}carbamoyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-({2-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]ethyl}carbamoyl)-beta-alaninate
ethyl N-({2-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]ethyl}carbamoyl)-beta-alaninate
Compound characteristics
| Compound ID: | L258-0178 |
| Compound Name: | ethyl N-({2-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]ethyl}carbamoyl)-beta-alaninate |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C20 H31 N3 O5 S |
| Smiles: | CCOC(CCNC(NCCC1CCN(CC1)S(c1ccc(C)cc1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2734 |
| logD: | 2.2734 |
| logSw: | -2.8885 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.01 |
| InChI Key: | ZFFLXVJVAAKVBV-UHFFFAOYSA-N |