N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-methyl-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-methyl-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-methyl-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
Compound characteristics
| Compound ID: | CM4435-0221 |
| Compound Name: | N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-methyl-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide |
| Molecular Weight: | 374.55 |
| Molecular Formula: | C20 H30 N4 O S |
| Smiles: | CCN(Cc1c(C)nn(CC)c1C)C(c1cc2CCCCN(C)c2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8685 |
| logD: | 2.8685 |
| logSw: | -3.083 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.784 |
| InChI Key: | ZUSYBGBUIFRUMR-UHFFFAOYSA-N |