5-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-(4-methylpiperidine-1-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-(4-methylpiperidine-1-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
5-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-(4-methylpiperidine-1-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-0939 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-2-methyl-3-(4-methylpiperidine-1-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C18 H21 N3 O5 S |
| Smiles: | CC1CCN(CC1)C(C1=CC(c2ccc3c(c2)OCO3)=NS(N1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3488 |
| logD: | 2.3488 |
| logSw: | -2.9223 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.991 |
| InChI Key: | UMHLFJKQYHJBAL-UHFFFAOYSA-N |