N-(1-methyl-1H-pyrazol-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(1-methyl-1H-pyrazol-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
N-(1-methyl-1H-pyrazol-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y501-2649 |
| Compound Name: | N-(1-methyl-1H-pyrazol-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 261.34 |
| Molecular Formula: | C13 H15 N3 O S |
| Smiles: | Cn1cc(cn1)NC(c1cc2CCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2792 |
| logD: | 2.2778 |
| logSw: | -2.7784 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.078 |
| InChI Key: | YCBWHDHANRNZDM-UHFFFAOYSA-N |