2-[3-chloro-4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione
Chemical Structure Depiction of
2-[3-chloro-4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione
2-[3-chloro-4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione
Compound characteristics
| Compound ID: | D473-1448 |
| Compound Name: | 2-[3-chloro-4-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione |
| Molecular Weight: | 478.95 |
| Molecular Formula: | C22 H23 Cl N2 O6 S |
| Smiles: | CC1CS(N(C1=O)c1ccc(C(N2CCc3cc(c(cc3C2)OC)OC)=O)c(c1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9017 |
| logD: | 1.9017 |
| logSw: | -3.2494 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.949 |
| InChI Key: | NPNRTLDBKXZPAH-CYBMUJFWSA-N |