5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3358-3679 |
| Compound Name: | 5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C23 H19 N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)n1c(C)cc(\C=C2/C(N(C(=S)S2)c2cccc(c2)[N+]([O-])=O)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.1653 |
| logD: | 5.1653 |
| logSw: | -5.0805 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 51.877 |
| InChI Key: | WJWFVMASYOEAGT-UHFFFAOYSA-N |