N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
Chemical Structure Depiction of
N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
Compound characteristics
| Compound ID: | CM4435-1330 |
| Compound Name: | N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide |
| Molecular Weight: | 418.6 |
| Molecular Formula: | C22 H34 N4 O2 S |
| Smiles: | CCN(Cc1c(C)nn(CC)c1C)C(c1cc2CCCCN(CCOC)c2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2201 |
| logD: | 3.2201 |
| logSw: | -3.2933 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.39 |
| InChI Key: | RTKPHRZUWJWKQP-UHFFFAOYSA-N |