1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0228 |
| Compound Name: | 1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-N-(4-phenoxyphenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C27 H25 N3 O4 S |
| Smiles: | Cc1ccc(cc1)c1cc(C(Nc2ccc(cc2)Oc2ccccc2)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8774 |
| logD: | 4.8774 |
| logSw: | -4.6271 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.171 |
| InChI Key: | MCWPPVFURLTGBP-JOCHJYFZSA-N |