3-[(5-{[(4-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-[(5-{[(4-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione
3-[(5-{[(4-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | Y020-0533 |
| Compound Name: | 3-[(5-{[(4-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione |
| Molecular Weight: | 476.04 |
| Molecular Formula: | C21 H18 Cl N3 O2 S3 |
| Smiles: | Cc1ccc(cc1C)N1C(CC(C1=O)Sc1nnc(SCc2ccc(cc2)[Cl])s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2802 |
| logD: | 5.2802 |
| logSw: | -5.8594 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.112 |
| InChI Key: | PHMNFQWHMNVEKJ-KRWDZBQOSA-N |