N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-5-(furan-2-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-5-(furan-2-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-5-(furan-2-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-1084 |
| Compound Name: | N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}-5-(furan-2-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 429.43 |
| Molecular Formula: | C19 H16 F N5 O4 S |
| Smiles: | CN1C(=CC(c2ccco2)=NS1(=O)=O)C(Nc1cnn(Cc2ccc(cc2)F)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6921 |
| logD: | 0.4365 |
| logSw: | -2.4643 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.402 |
| InChI Key: | SJEIKLWPWRSTMQ-UHFFFAOYSA-N |