N-(3-acetylphenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
N-(3-acetylphenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | J049-0922 |
| Compound Name: | N-(3-acetylphenyl)-3-methyl-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazine-7-carboxamide |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | CCCN1C(C)=NS(c2cc(ccc12)C(Nc1cccc(c1)C(C)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7657 |
| logD: | 2.7481 |
| logSw: | -3.3083 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.496 |
| InChI Key: | LLMYDVJGZGGMBG-UHFFFAOYSA-N |