N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide
N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0214 |
| Compound Name: | N-(3-bromo-4-methylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 488.4 |
| Molecular Formula: | C22 H22 Br N3 O3 S |
| Smiles: | Cc1ccc(cc1)c1cc(C(Nc2ccc(C)c(c2)[Br])=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2794 |
| logD: | 4.2791 |
| logSw: | -4.2142 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.423 |
| InChI Key: | OGAHMTWYKZKKPG-SFHVURJKSA-N |