2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-1189 |
| Compound Name: | 2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C20 H19 N5 O3 S2 |
| Smiles: | Cc1ccc(Cn2ccc(NC(C3=CC(c4cccs4)=NS(N3C)(=O)=O)=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1203 |
| logD: | 1.2192 |
| logSw: | -3.4044 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.293 |
| InChI Key: | RONWOTUEQYJTOY-UHFFFAOYSA-N |