N-{3-[(4-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-{3-[(4-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
N-{3-[(4-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y203-3380 |
| Compound Name: | N-{3-[(4-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C22 H24 N4 O2 S |
| Smiles: | CCc1ccc(cc1)NC(c1c2CCCCc2sc1NC(c1ccnn1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3445 |
| logD: | 3.1745 |
| logSw: | -4.4288 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.786 |
| InChI Key: | JFXGZGVQIMMWBB-UHFFFAOYSA-N |