3-methyl-5-{[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-methyl-5-{[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
3-methyl-5-{[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | C357-9252 |
| Compound Name: | 3-methyl-5-{[1-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 384.5 |
| Molecular Formula: | C17 H12 N4 O S3 |
| Smiles: | CN1C(/C(=C/c2cccn2c2nnc(c3ccccc3)s2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9048 |
| logD: | 3.9048 |
| logSw: | -4.0587 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.056 |
| InChI Key: | BBEASTGQEAODTC-UHFFFAOYSA-N |