N-{N-[2-(5-chloro-1H-indol-3-yl)ethyl]-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl}-N'-(2-methylphenyl)thiourea
Chemical Structure Depiction of
N-{N-[2-(5-chloro-1H-indol-3-yl)ethyl]-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl}-N'-(2-methylphenyl)thiourea
N-{N-[2-(5-chloro-1H-indol-3-yl)ethyl]-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl}-N'-(2-methylphenyl)thiourea
Compound characteristics
| Compound ID: | Y021-1986 |
| Compound Name: | N-{N-[2-(5-chloro-1H-indol-3-yl)ethyl]-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl}-N'-(2-methylphenyl)thiourea |
| Molecular Weight: | 492.04 |
| Molecular Formula: | C25 H26 Cl N7 S |
| Smiles: | Cc1ccccc1NC(NC(/NCCc1c[nH]c2ccc(cc12)[Cl])=N/c1nc(C)cc(C)n1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.1407 |
| logD: | 3.1607 |
| logSw: | -5.5515 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 65.915 |
| InChI Key: | ZEYMNJWUPJTPIS-UHFFFAOYSA-N |