N,5-bis(2H-1,3-benzodioxol-5-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
N,5-bis(2H-1,3-benzodioxol-5-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
N,5-bis(2H-1,3-benzodioxol-5-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-0921 |
| Compound Name: | N,5-bis(2H-1,3-benzodioxol-5-yl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 429.41 |
| Molecular Formula: | C19 H15 N3 O7 S |
| Smiles: | CN1C(=CC(c2ccc3c(c2)OCO3)=NS1(=O)=O)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.555 |
| logD: | 1.8707 |
| logSw: | -3.1084 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.549 |
| InChI Key: | XMFBMUJEZGXOBA-UHFFFAOYSA-N |