N'-(4-methylphenyl)-N-[1-(3-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
Chemical Structure Depiction of
N'-(4-methylphenyl)-N-[1-(3-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
N'-(4-methylphenyl)-N-[1-(3-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
Compound characteristics
| Compound ID: | Y500-6473 |
| Compound Name: | N'-(4-methylphenyl)-N-[1-(3-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C26 H29 N5 O2 S |
| Smiles: | Cc1ccc(cc1)NC(N(Cc1c(C)nn(C)c1C)C1CC(N(C1=O)c1cccc(C)c1)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.335 |
| logD: | 3.335 |
| logSw: | -3.6501 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.976 |
| InChI Key: | ZCRDDEPTRXWGSW-QHCPKHFHSA-N |