3-(azepane-1-sulfonyl)-1-ethyl-N-(2-fluoro-4-methoxyphenyl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-1-ethyl-N-(2-fluoro-4-methoxyphenyl)-1H-pyrazole-4-carboxamide
3-(azepane-1-sulfonyl)-1-ethyl-N-(2-fluoro-4-methoxyphenyl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-8167F |
| Compound Name: | 3-(azepane-1-sulfonyl)-1-ethyl-N-(2-fluoro-4-methoxyphenyl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C19 H25 F N4 O4 S |
| Smiles: | CCn1cc(C(Nc2ccc(cc2F)OC)=O)c(n1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.732 |
| logD: | 2.6382 |
| logSw: | -3.3751 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.041 |
| InChI Key: | SJKXQKCKXJUNRZ-UHFFFAOYSA-N |