2-{3-chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione
Chemical Structure Depiction of
2-{3-chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione
2-{3-chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione
Compound characteristics
| Compound ID: | D473-1441 |
| Compound Name: | 2-{3-chloro-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}-4-methyl-1lambda~6~,2-thiazolidine-1,1,3-trione |
| Molecular Weight: | 449.91 |
| Molecular Formula: | C19 H20 Cl N5 O4 S |
| Smiles: | CC1CS(N(C1=O)c1ccc(C(N2CCN(CC2)c2ncccn2)=O)c(c1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2487 |
| logD: | 1.2487 |
| logSw: | -2.9927 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.649 |
| InChI Key: | HZVGURJMUBGPRH-CYBMUJFWSA-N |