5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-3-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-3-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-3-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 8015-7216 |
| Compound Name: | 5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-3-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 406.53 |
| Molecular Formula: | C21 H18 N4 O S2 |
| Smiles: | Cc1cc(/C=C2/C(N(Cc3cccnc3)C(=S)S2)=O)c(C)n1c1cccnc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9133 |
| logD: | 2.9126 |
| logSw: | -2.8961 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.143 |
| InChI Key: | ABPKAULRVBQTGX-UHFFFAOYSA-N |