3-(azepane-1-carbonyl)-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Chemical Structure Depiction of
3-(azepane-1-carbonyl)-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
3-(azepane-1-carbonyl)-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Compound characteristics
| Compound ID: | M786-3080 |
| Compound Name: | 3-(azepane-1-carbonyl)-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C17 H23 N3 O3 S |
| Smiles: | CC(C)N1c2ccccc2S(C(C(N2CCCCCC2)=O)=N1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6348 |
| logD: | 2.6348 |
| logSw: | -3.059 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.853 |
| InChI Key: | FOMMUKHTSHMENN-UHFFFAOYSA-N |