5-(4-fluorophenyl)-2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
5-(4-fluorophenyl)-2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
5-(4-fluorophenyl)-2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-0564 |
| Compound Name: | 5-(4-fluorophenyl)-2-methyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 453.49 |
| Molecular Formula: | C22 H20 F N5 O3 S |
| Smiles: | Cc1ccc(Cn2ccc(NC(C3=CC(c4ccc(cc4)F)=NS(N3C)(=O)=O)=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3301 |
| logD: | 1.4519 |
| logSw: | -3.6294 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.274 |
| InChI Key: | ZHFPJDZAVMUHLR-UHFFFAOYSA-N |