5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-3-propyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-3-propyl-2-sulfanylideneimidazolidin-4-one
5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-3-propyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 5791-4345 |
| Compound Name: | 5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-3-propyl-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 384.46 |
| Molecular Formula: | C19 H20 N4 O3 S |
| Smiles: | CCCN1C(/C(=C/c2cc(C)n(c3ccc(cc3)[N+]([O-])=O)c2C)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7254 |
| logD: | 3.7243 |
| logSw: | -3.8376 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.804 |
| InChI Key: | QIOOYAYYEKTHQI-UHFFFAOYSA-N |