N-(3-chloro-4-methylphenyl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
N-(3-chloro-4-methylphenyl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Compound characteristics
| Compound ID: | E983-1380 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-N'-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea |
| Molecular Weight: | 397.9 |
| Molecular Formula: | C22 H24 Cl N3 O2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(NCc1cc(C)n(c2ccc(cc2)OC)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3023 |
| logD: | 5.3023 |
| logSw: | -5.9486 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.072 |
| InChI Key: | YJMLXBWAKYTISQ-UHFFFAOYSA-N |