ethyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8002-2652 |
| Compound Name: | ethyl 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 239.33 |
| Molecular Formula: | C12 H17 N O2 S |
| Smiles: | CCOC(c1c2CCC(C)Cc2sc1N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0426 |
| logD: | 3.0426 |
| logSw: | -3.2116 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.189 |
| InChI Key: | WSOISFMHBFFWRQ-SSDOTTSWSA-N |