methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | R052-1711 |
| Compound Name: | methyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 211.28 |
| Molecular Formula: | C10 H13 N O2 S |
| Smiles: | COC(c1c2CCCCc2sc1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2263 |
| logD: | 2.2263 |
| logSw: | -2.0366 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.609 |
| InChI Key: | DKYYKIHEIOOWRB-UHFFFAOYSA-N |