ethyl 2-[3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 7393-4051 |
| Compound Name: | ethyl 2-[3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 430.54 |
| Molecular Formula: | C21 H22 N2 O4 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CCN1C(=O)Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2915 |
| logD: | 1.3597 |
| logSw: | -4.2569 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.408 |
| InChI Key: | DLLRNSJBWRNWQP-UHFFFAOYSA-N |