N-(4-bromo-2-fluorophenyl)-N'-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methyl}urea
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-N'-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methyl}urea
N-(4-bromo-2-fluorophenyl)-N'-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methyl}urea
Compound characteristics
| Compound ID: | E983-1246 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-N'-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methyl}urea |
| Molecular Weight: | 430.32 |
| Molecular Formula: | C21 H21 Br F N3 O |
| Smiles: | Cc1ccc(cc1)n1c(C)cc(CNC(Nc2ccc(cc2F)[Br])=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.0346 |
| logD: | 5.0341 |
| logSw: | -4.6809 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.831 |
| InChI Key: | TXCKMKGAEKQQSK-UHFFFAOYSA-N |