N-(adamantan-1-yl)-N'-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Chemical Structure Depiction of
N-(adamantan-1-yl)-N'-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
N-(adamantan-1-yl)-N'-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea
Compound characteristics
| Compound ID: | E983-1346 |
| Compound Name: | N-(adamantan-1-yl)-N'-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}urea |
| Molecular Weight: | 411.97 |
| Molecular Formula: | C24 H30 Cl N3 O |
| Smiles: | Cc1cc(CNC(NC23CC4CC(CC(C4)C3)C2)=O)c(C)n1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2642 |
| logD: | 5.2642 |
| logSw: | -5.8135 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.546 |
| InChI Key: | XVUGDHFSCZKGTD-UHFFFAOYSA-N |