3-(3,4-dihydroquinoline-1(2H)-carbonyl)-5-(4-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(3,4-dihydroquinoline-1(2H)-carbonyl)-5-(4-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-(3,4-dihydroquinoline-1(2H)-carbonyl)-5-(4-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-0249 |
| Compound Name: | 3-(3,4-dihydroquinoline-1(2H)-carbonyl)-5-(4-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | CN1C(=CC(c2ccc(cc2)OC)=NS1(=O)=O)C(N1CCCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.389 |
| logD: | 3.389 |
| logSw: | -3.8201 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.084 |
| InChI Key: | BQMYVZAFKCLFEV-UHFFFAOYSA-N |