3-(azepane-1-carbonyl)-7-methyl-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Chemical Structure Depiction of
3-(azepane-1-carbonyl)-7-methyl-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
3-(azepane-1-carbonyl)-7-methyl-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione
Compound characteristics
| Compound ID: | M786-3429 |
| Compound Name: | 3-(azepane-1-carbonyl)-7-methyl-1-(propan-2-yl)-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione |
| Molecular Weight: | 363.48 |
| Molecular Formula: | C18 H25 N3 O3 S |
| Smiles: | CC(C)N1c2cc(C)ccc2S(C(C(N2CCCCCC2)=O)=N1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2518 |
| logD: | 3.2518 |
| logSw: | -3.5713 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.853 |
| InChI Key: | JZZUXHYUQSWXCV-UHFFFAOYSA-N |