3-(azepane-1-sulfonyl)-1-ethyl-N-(4-fluorophenyl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-1-ethyl-N-(4-fluorophenyl)-1H-pyrazole-4-carboxamide
3-(azepane-1-sulfonyl)-1-ethyl-N-(4-fluorophenyl)-1H-pyrazole-4-carboxamide
Compound characteristics
Compound ID: | M461-8154 |
Compound Name: | 3-(azepane-1-sulfonyl)-1-ethyl-N-(4-fluorophenyl)-1H-pyrazole-4-carboxamide |
Molecular Weight: | 394.47 |
Molecular Formula: | C18 H23 F N4 O3 S |
Smiles: | CCn1cc(C(Nc2ccc(cc2)F)=O)c(n1)S(N1CCCCCC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5801 |
logD: | 2.5414 |
logSw: | -3.1413 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.195 |
InChI Key: | KGMTYIKPASLPLW-UHFFFAOYSA-N |