methyl 2-amino-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-amino-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-amino-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-0011 |
| Compound Name: | methyl 2-amino-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 281.42 |
| Molecular Formula: | C15 H23 N O2 S |
| Smiles: | CCC(C)(C)C1CCc2c(C(=O)OC)c(N)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.692 |
| logD: | 3.692 |
| logSw: | -4.2117 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.609 |
| InChI Key: | LPKSLOJMDBPGDS-SECBINFHSA-N |