ethyl N-benzyl-N-(5-carbamoylthiophene-3-sulfonyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-benzyl-N-(5-carbamoylthiophene-3-sulfonyl)-beta-alaninate
ethyl N-benzyl-N-(5-carbamoylthiophene-3-sulfonyl)-beta-alaninate
Compound characteristics
| Compound ID: | G017-4240 |
| Compound Name: | ethyl N-benzyl-N-(5-carbamoylthiophene-3-sulfonyl)-beta-alaninate |
| Molecular Weight: | 396.48 |
| Molecular Formula: | C17 H20 N2 O5 S2 |
| Smiles: | CCOC(CCN(Cc1ccccc1)S(c1cc(C(N)=O)sc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0141 |
| logD: | 2.0141 |
| logSw: | -2.7253 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.828 |
| InChI Key: | DKSMVUFBDMMBQT-UHFFFAOYSA-N |