5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one
5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 2368-1313 |
| Compound Name: | 5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C23 H20 N4 O3 S |
| Smiles: | Cc1ccc(cc1)/N=C1/NC(/C(=C\c2cc(C)n(c3cccc(c3)[N+]([O-])=O)c2C)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4765 |
| logD: | 4.4764 |
| logSw: | -4.369 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.199 |
| InChI Key: | BZLMOUWVCAOJSG-UHFFFAOYSA-N |