methyl 2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
methyl 2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y507-1791 |
| Compound Name: | methyl 2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate |
| Molecular Weight: | 239.33 |
| Molecular Formula: | C12 H17 N O2 S |
| Smiles: | COC(c1c2CCCCCCc2sc1N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2182 |
| logD: | 3.2182 |
| logSw: | -3.4103 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.94 |
| InChI Key: | KMQMOTGFHOYIBQ-UHFFFAOYSA-N |