5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4058-0339 |
| Compound Name: | 5-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 382.55 |
| Molecular Formula: | C21 H22 N2 O S2 |
| Smiles: | Cc1ccc(cc1C)n1c(C)cc(/C=C2/C(N(CC=C)C(=S)S2)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.3155 |
| logD: | 5.3155 |
| logSw: | -5.2256 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 19.3571 |
| InChI Key: | XWKVQMXKQCWYBC-UHFFFAOYSA-N |