N-(3-chloro-4-fluorophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
N-(3-chloro-4-fluorophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D473-1909 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 463.91 |
| Molecular Formula: | C21 H19 Cl F N3 O4 S |
| Smiles: | COc1ccc(cc1)c1cc(C(Nc2ccc(c(c2)[Cl])F)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4765 |
| logD: | 3.4635 |
| logSw: | -4.0453 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.967 |
| InChI Key: | UHLFEQDNBWUNCZ-HNNXBMFYSA-N |