methyl 2-(2,6-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(2,6-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-(2,6-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3772-3488 |
| Compound Name: | methyl 2-(2,6-dimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 375.44 |
| Molecular Formula: | C19 H21 N O5 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(c1c(cccc1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2799 |
| logD: | -2.92 |
| logSw: | -3.7436 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.479 |
| InChI Key: | PJUFIBPDJRVJBQ-UHFFFAOYSA-N |