ethyl 2-{[3-(2-chlorophenyl)-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-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3508-1335 |
| Compound Name: | ethyl 2-{[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C22 H21 Cl N2 O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1c(c2ccccc2[Cl])noc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.971 |
| logD: | 1.1887 |
| logSw: | -5.1075 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.758 |
| InChI Key: | OFNFQECALWDBEW-UHFFFAOYSA-N |