N-(3-acetylphenyl)-3-methyl-4-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-3-methyl-4-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
N-(3-acetylphenyl)-3-methyl-4-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | J049-2162 |
| Compound Name: | N-(3-acetylphenyl)-3-methyl-4-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | CC(C)CN1C(C)=NS(c2cc(ccc12)C(Nc1cccc(c1)C(C)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2176 |
| logD: | 3.2001 |
| logSw: | -3.6253 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.517 |
| InChI Key: | QWPKIHKEOZCNHT-UHFFFAOYSA-N |