N-[2-(4-chlorophenyl)ethyl]-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethoxyphenyl)thiourea
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethoxyphenyl)thiourea
N-[2-(4-chlorophenyl)ethyl]-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethoxyphenyl)thiourea
Compound characteristics
| Compound ID: | K788-3419 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-N-({1-[(2,4-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-N'-(2-ethoxyphenyl)thiourea |
| Molecular Weight: | 532.15 |
| Molecular Formula: | C31 H34 Cl N3 O S |
| Smiles: | CCOc1ccccc1NC(N(CCc1ccc(cc1)[Cl])Cc1cccn1Cc1ccc(C)cc1C)=S |
| Stereo: | ACHIRAL |
| logP: | 8.3915 |
| logD: | 8.3915 |
| logSw: | -6.4386 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 18.9891 |
| InChI Key: | SXOIZDGBIUIJCN-UHFFFAOYSA-N |