methyl 2-(2-chloroacetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(2-chloroacetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-(2-chloroacetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 1630-1160 |
| Compound Name: | methyl 2-(2-chloroacetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 287.76 |
| Molecular Formula: | C12 H14 Cl N O3 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(C[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5436 |
| logD: | -0.9608 |
| logSw: | -2.7228 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.277 |
| InChI Key: | DNHJHAGGYDWGEO-UHFFFAOYSA-N |