N-(adamantan-1-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea
Chemical Structure Depiction of
N-(adamantan-1-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea
N-(adamantan-1-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea
Compound characteristics
| Compound ID: | G331-0450 |
| Compound Name: | N-(adamantan-1-yl)-N'-({1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)urea |
| Molecular Weight: | 405.58 |
| Molecular Formula: | C26 H35 N3 O |
| Smiles: | Cc1cc(C)c(Cn2cccc2CNC(NC23CC4CC(CC(C4)C3)C2)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1166 |
| logD: | 6.1166 |
| logSw: | -5.3988 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.952 |
| InChI Key: | PUEBLWLTSKHFPW-UHFFFAOYSA-N |