N-(2-ethyl-6-methylphenyl)-N'-[(1-methyl-1H-pyrrol-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-N'-[(1-methyl-1H-pyrrol-2-yl)methyl]thiourea
N-(2-ethyl-6-methylphenyl)-N'-[(1-methyl-1H-pyrrol-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | K788-0590 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-N'-[(1-methyl-1H-pyrrol-2-yl)methyl]thiourea |
| Molecular Weight: | 287.42 |
| Molecular Formula: | C16 H21 N3 S |
| Smiles: | CCc1cccc(C)c1NC(NCc1cccn1C)=S |
| Stereo: | ACHIRAL |
| logP: | 3.4964 |
| logD: | 3.4964 |
| logSw: | -3.5367 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 21.8852 |
| InChI Key: | XUAZDDKUQXFIIH-UHFFFAOYSA-N |