1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methylphenyl)methyl]-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methylphenyl)methyl]-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methylphenyl)methyl]-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0022 |
| Compound Name: | 1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methylphenyl)methyl]-5-(thiophen-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 415.53 |
| Molecular Formula: | C20 H21 N3 O3 S2 |
| Smiles: | Cc1ccc(CNC(c2cc(c3cccs3)n(C3CCS(C3)(=O)=O)n2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5948 |
| logD: | 2.5948 |
| logSw: | -3.0148 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.763 |
| InChI Key: | FYHOHGNJXBAGJU-MRXNPFEDSA-N |