5-chloro-2-methoxy-N-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
Chemical Structure Depiction of
5-chloro-2-methoxy-N-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
5-chloro-2-methoxy-N-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide
Compound characteristics
| Compound ID: | K410-0241 |
| Compound Name: | 5-chloro-2-methoxy-N-[2-(4-methylphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]benzamide |
| Molecular Weight: | 431.9 |
| Molecular Formula: | C20 H18 Cl N3 O4 S |
| Smiles: | Cc1ccc(cc1)n1c(c2CS(Cc2n1)(=O)=O)NC(c1cc(ccc1OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0841 |
| logD: | 2.7969 |
| logSw: | -3.5733 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.332 |
| InChI Key: | FIJHOGALPKUIFD-UHFFFAOYSA-N |