N'-(4-chlorophenyl)-N-[1-(3,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-{2-[(5-nitropyridin-2-yl)amino]ethyl}thiourea
Chemical Structure Depiction of
N'-(4-chlorophenyl)-N-[1-(3,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-{2-[(5-nitropyridin-2-yl)amino]ethyl}thiourea
N'-(4-chlorophenyl)-N-[1-(3,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-{2-[(5-nitropyridin-2-yl)amino]ethyl}thiourea
Compound characteristics
| Compound ID: | 8010-5420 |
| Compound Name: | N'-(4-chlorophenyl)-N-[1-(3,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-{2-[(5-nitropyridin-2-yl)amino]ethyl}thiourea |
| Molecular Weight: | 593.87 |
| Molecular Formula: | C24 H19 Cl3 N6 O4 S |
| Smiles: | C1C(C(N(C1=O)c1ccc(c(c1)[Cl])[Cl])=O)N(CCNc1ccc(cn1)[N+]([O-])=O)C(Nc1ccc(cc1)[Cl])=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2233 |
| logD: | 5.2233 |
| logSw: | -5.8726 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.549 |
| InChI Key: | PAXSGBFDWSEBMN-HXUWFJFHSA-N |