5-(3,4-dimethylphenyl)-N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-(3,4-dimethylphenyl)-N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-1H-pyrazole-3-carboxamide
5-(3,4-dimethylphenyl)-N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0283 |
| Compound Name: | 5-(3,4-dimethylphenyl)-N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 465.59 |
| Molecular Formula: | C21 H27 N3 O5 S2 |
| Smiles: | Cc1ccc(cc1C)c1cc(C(N(C)C2CCS(C2)(=O)=O)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.8713 |
| logD: | 0.8713 |
| logSw: | -2.0491 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.971 |
| InChI Key: | VJUQNKNRKCPLQC-UHFFFAOYSA-N |