methyl 2-(3,4-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(3,4-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-(3,4-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3772-3694 |
| Compound Name: | methyl 2-(3,4-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 384.28 |
| Molecular Formula: | C17 H15 Cl2 N O3 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(c1ccc(c(c1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0413 |
| logD: | -0.4315 |
| logSw: | -5.6344 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.218 |
| InChI Key: | WXFBJEAXHYLCHX-UHFFFAOYSA-N |