3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperazin-1-yl)-1-(2-methylpropyl)-1H-pyrrole-2,5-dione
Chemical Structure Depiction of
3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperazin-1-yl)-1-(2-methylpropyl)-1H-pyrrole-2,5-dione
3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperazin-1-yl)-1-(2-methylpropyl)-1H-pyrrole-2,5-dione
Compound characteristics
| Compound ID: | V009-2559 |
| Compound Name: | 3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(4-methylpiperazin-1-yl)-1-(2-methylpropyl)-1H-pyrrole-2,5-dione |
| Molecular Weight: | 506.43 |
| Molecular Formula: | C24 H29 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | CCc1c(C2=C(C(N(CC(C)C)C2=O)=O)N2CCN(C)CC2)c(n(c2ccc(c(c2)[Cl])[Cl])n1)O |
| Stereo: | ACHIRAL |
| logP: | 3.8504 |
| logD: | 2.6347 |
| logSw: | -3.964 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.149 |
| InChI Key: | NXFLDPTYMNJIGC-UHFFFAOYSA-N |