N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide
N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
Compound ID: | D627-0166 |
Compound Name: | N,1-bis(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-methyl-5-(4-methylphenyl)-1H-pyrazole-3-carboxamide |
Molecular Weight: | 451.56 |
Molecular Formula: | C20 H25 N3 O5 S2 |
Smiles: | Cc1ccc(cc1)c1cc(C(N(C)C2CCS(C2)(=O)=O)=O)nn1C1CCS(C1)(=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 0.4324 |
logD: | 0.4324 |
logSw: | -2.0208 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 84.971 |
InChI Key: | JPFRKGNJGQYJBX-UHFFFAOYSA-N |