N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-1187 |
| Compound Name: | N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C19 H16 F N5 O3 S2 |
| Smiles: | CN1C(=CC(c2cccs2)=NS1(=O)=O)C(Nc1cnn(Cc2ccc(cc2)F)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.43 |
| logD: | 1.1744 |
| logSw: | -2.7943 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.842 |
| InChI Key: | RZYPMVYMDRJPCR-UHFFFAOYSA-N |