2-methyl-N-(5-methyl-1-{2-oxo-2-[(pyridin-3-yl)amino]ethyl}-1H-pyrazol-3-yl)-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-(5-methyl-1-{2-oxo-2-[(pyridin-3-yl)amino]ethyl}-1H-pyrazol-3-yl)-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
2-methyl-N-(5-methyl-1-{2-oxo-2-[(pyridin-3-yl)amino]ethyl}-1H-pyrazol-3-yl)-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-1247 |
| Compound Name: | 2-methyl-N-(5-methyl-1-{2-oxo-2-[(pyridin-3-yl)amino]ethyl}-1H-pyrazol-3-yl)-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 493.54 |
| Molecular Formula: | C23 H23 N7 O4 S |
| Smiles: | Cc1ccc(cc1)C1C=C(C(Nc2cc(C)n(CC(Nc3cccnc3)=O)n2)=O)N(C)S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1047 |
| logD: | -0.9931 |
| logSw: | -2.7393 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.482 |
| InChI Key: | GZAPNGHZEMGHHA-UHFFFAOYSA-N |