N-[1-(2,6-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methoxyphenyl)thiourea
Chemical Structure Depiction of
N-[1-(2,6-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methoxyphenyl)thiourea
N-[1-(2,6-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methoxyphenyl)thiourea
Compound characteristics
| Compound ID: | Y500-5839 |
| Compound Name: | N-[1-(2,6-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methoxyphenyl)thiourea |
| Molecular Weight: | 532.45 |
| Molecular Formula: | C24 H23 Cl2 N5 O3 S |
| Smiles: | Cc1c(CN(C2CC(N(C2=O)c2c(cccc2[Cl])[Cl])=O)C(Nc2ccccc2OC)=S)cn(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6647 |
| logD: | 3.6647 |
| logSw: | -3.8986 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.629 |
| InChI Key: | BSAAVOQSEPBXOA-LJQANCHMSA-N |