3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-0167 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C21 H21 N3 O3 S |
| Smiles: | Cc1ccc(cc1)C1C=C(C(N2CCc3ccccc3C2)=O)N(C)S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4322 |
| logD: | 3.4322 |
| logSw: | -3.6316 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.537 |
| InChI Key: | JCTBUQAHMMREMS-UHFFFAOYSA-N |