2-[(6-methyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-propylacetamide
Chemical Structure Depiction of
2-[(6-methyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-propylacetamide
2-[(6-methyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-propylacetamide
Compound characteristics
| Compound ID: | K261-2026 |
| Compound Name: | 2-[(6-methyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-propylacetamide |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C13 H17 N3 O3 S2 |
| Smiles: | CCCNC(CSC1Nc2cc(C)ccc2S(N=1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3662 |
| logD: | 1.3283 |
| logSw: | -2.4438 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.29 |
| InChI Key: | DCAUDQLMESSPAF-UHFFFAOYSA-N |