methyl 5-[(3-bromophenyl)carbamamido]-3-ethoxy-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-[(3-bromophenyl)carbamamido]-3-ethoxy-1-benzothiophene-2-carboxylate
methyl 5-[(3-bromophenyl)carbamamido]-3-ethoxy-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | L311-0031 |
| Compound Name: | methyl 5-[(3-bromophenyl)carbamamido]-3-ethoxy-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 449.32 |
| Molecular Formula: | C19 H17 Br N2 O4 S |
| Smiles: | CCOc1c2cc(ccc2sc1C(=O)OC)NC(Nc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8255 |
| logD: | 5.8255 |
| logSw: | -5.6025 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.759 |
| InChI Key: | URKRIRRYGFSWCW-UHFFFAOYSA-N |