5-(2H-1,3-benzodioxol-5-yl)-2-methyl-N-[2-(morpholin-4-yl)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-2-methyl-N-[2-(morpholin-4-yl)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
5-(2H-1,3-benzodioxol-5-yl)-2-methyl-N-[2-(morpholin-4-yl)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-0960 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-2-methyl-N-[2-(morpholin-4-yl)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C18 H22 N4 O6 S |
| Smiles: | CN1C(=CC(c2ccc3c(c2)OCO3)=NS1(=O)=O)C(NCCN1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5039 |
| logD: | 0.4379 |
| logSw: | -2.4038 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.489 |
| InChI Key: | BXCIKBZRILXQKM-UHFFFAOYSA-N |