ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4606-0928 |
| Compound Name: | ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 479.38 |
| Molecular Formula: | C22 H20 Cl2 N2 O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1c(c2c(cccc2[Cl])[Cl])noc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2817 |
| logD: | 0.56 |
| logSw: | -5.9686 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.758 |
| InChI Key: | XHHQBUKYRQSUJI-UHFFFAOYSA-N |