N-[1-(adamantan-1-yl)-1H-pyrazol-3-yl]-N'-cyclopentylthiourea
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)-1H-pyrazol-3-yl]-N'-cyclopentylthiourea
N-[1-(adamantan-1-yl)-1H-pyrazol-3-yl]-N'-cyclopentylthiourea
Compound characteristics
| Compound ID: | Y503-4000 |
| Compound Name: | N-[1-(adamantan-1-yl)-1H-pyrazol-3-yl]-N'-cyclopentylthiourea |
| Molecular Weight: | 344.52 |
| Molecular Formula: | C19 H28 N4 S |
| Smiles: | C1CCC(C1)NC(Nc1ccn(C23CC4CC(CC(C4)C3)C2)n1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.6495 |
| logD: | 4.6445 |
| logSw: | -4.7287 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 34.974 |
| InChI Key: | FXBDQYAJIFDJRX-UHFFFAOYSA-N |