(5-{[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)acetic acid
Chemical Structure Depiction of
(5-{[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)acetic acid
(5-{[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)acetic acid
Compound characteristics
| Compound ID: | 5097-2991 |
| Compound Name: | (5-{[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)acetic acid |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C22 H24 N2 O4 S |
| Smiles: | Cc1cc(/C=C2/C(N(CC(O)=O)C(=O)S2)=O)c(C)n1c1ccc(cc1)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.8106 |
| logD: | 0.0857 |
| logSw: | -3.8748 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.916 |
| InChI Key: | OKSNHMFJDCEMAF-UHFFFAOYSA-N |