3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-1163 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C18 H17 N3 O3 S2 |
| Smiles: | CN1C(=CC(c2cccs2)=NS1(=O)=O)C(N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8281 |
| logD: | 2.8281 |
| logSw: | -3.2772 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.556 |
| InChI Key: | UWFJVLDHSTYRRO-UHFFFAOYSA-N |