N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methylpropyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
Chemical Structure Depiction of
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methylpropyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methylpropyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide
Compound characteristics
| Compound ID: | CM4435-3831 |
| Compound Name: | N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-(2-methylpropyl)-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepine-2-carboxamide |
| Molecular Weight: | 360.52 |
| Molecular Formula: | C19 H28 N4 O S |
| Smiles: | CC(C)CN1CCCCc2cc(C(NCc3c(C)n[nH]c3C)=O)sc12 |
| Stereo: | ACHIRAL |
| logP: | 4.0592 |
| logD: | 4.0592 |
| logSw: | -4.0232 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.184 |
| InChI Key: | WQVZTPFKCWZQLO-UHFFFAOYSA-N |