3-(5-amino-1,3-dimethyl-1H-pyrazol-4-yl)-1-[3-(methylsulfanyl)phenyl]pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-(5-amino-1,3-dimethyl-1H-pyrazol-4-yl)-1-[3-(methylsulfanyl)phenyl]pyrrolidine-2,5-dione
3-(5-amino-1,3-dimethyl-1H-pyrazol-4-yl)-1-[3-(methylsulfanyl)phenyl]pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | IB05-8776 |
| Compound Name: | 3-(5-amino-1,3-dimethyl-1H-pyrazol-4-yl)-1-[3-(methylsulfanyl)phenyl]pyrrolidine-2,5-dione |
| Molecular Weight: | 330.41 |
| Molecular Formula: | C16 H18 N4 O2 S |
| Smiles: | Cc1c(C2CC(N(C2=O)c2cccc(c2)SC)=O)c(N)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.31 |
| logD: | 0.3 |
| logSw: | -1.95 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 173.32 |
| InChI Key: | DHCAKPCCDQPSEP-GFCCVEGCSA-N |