N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-8-(2-methoxyethyl)-N-methyl-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
Chemical Structure Depiction of
N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-8-(2-methoxyethyl)-N-methyl-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-8-(2-methoxyethyl)-N-methyl-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
Compound characteristics
| Compound ID: | CM4435-1123 |
| Compound Name: | N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-8-(2-methoxyethyl)-N-methyl-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: | CCn1c(C)c(CCN(C)C(c2cc3CCCCN(CCOC)c3s2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9493 |
| logD: | 2.9488 |
| logSw: | -3.1196 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.583 |
| InChI Key: | HRMKFLWSPGWIHJ-UHFFFAOYSA-N |