3-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione
3-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | Y020-8040 |
| Compound Name: | 3-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C21 H15 Cl N4 O3 S |
| Smiles: | Cc1c(C2CC(N(C2=O)c2cccc(c2)[Cl])=O)c(n(c2nc3ccccc3s2)n1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0956 |
| logD: | 2.099 |
| logSw: | -3.284 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.543 |
| InChI Key: | GMPPCXXEGBMZGJ-CQSZACIVSA-N |