5-(furan-2-yl)-2-methyl-3-(4-methyloctahydroquinoline-1(2H)-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
5-(furan-2-yl)-2-methyl-3-(4-methyloctahydroquinoline-1(2H)-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
5-(furan-2-yl)-2-methyl-3-(4-methyloctahydroquinoline-1(2H)-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-1067 |
| Compound Name: | 5-(furan-2-yl)-2-methyl-3-(4-methyloctahydroquinoline-1(2H)-carbonyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C19 H25 N3 O4 S |
| Smiles: | CC1CCN(C2CCCCC12)C(C1=CC(c2ccco2)=NS(N1C)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4702 |
| logD: | 2.4702 |
| logSw: | -2.5308 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.664 |
| InChI Key: | RERZDHKTOIPMBG-UHFFFAOYSA-N |