6-methyl-2-(3,4,5-trimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Chemical Structure Depiction of
6-methyl-2-(3,4,5-trimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
6-methyl-2-(3,4,5-trimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Compound characteristics
| Compound ID: | 5596-0722 |
| Compound Name: | 6-methyl-2-(3,4,5-trimethoxybenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid |
| Molecular Weight: | 405.47 |
| Molecular Formula: | C20 H23 N O6 S |
| Smiles: | CC1CCc2c(C(O)=O)c(NC(c3cc(c(c(c3)OC)OC)OC)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6604 |
| logD: | 0.3528 |
| logSw: | -4.1858 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.431 |
| InChI Key: | QECONBDPHOKWPN-SNVBAGLBSA-N |