3-[1-(2,5-dimethylphenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperidin-1-yl)-1-propyl-1H-pyrrole-2,5-dione
Chemical Structure Depiction of
3-[1-(2,5-dimethylphenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperidin-1-yl)-1-propyl-1H-pyrrole-2,5-dione
3-[1-(2,5-dimethylphenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperidin-1-yl)-1-propyl-1H-pyrrole-2,5-dione
Compound characteristics
| Compound ID: | V011-4487 |
| Compound Name: | 3-[1-(2,5-dimethylphenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperidin-1-yl)-1-propyl-1H-pyrrole-2,5-dione |
| Molecular Weight: | 450.58 |
| Molecular Formula: | C26 H34 N4 O3 |
| Smiles: | CCCN1C(C(=C(C1=O)N1CCC(C)CC1)c1c(CC)nn(c2cc(C)ccc2C)c1O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5354 |
| logD: | 3.8081 |
| logSw: | -4.3019 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.349 |
| InChI Key: | VFVIASJXQRVCNK-UHFFFAOYSA-N |