N-(adamantan-1-yl)-N'-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}urea
Chemical Structure Depiction of
N-(adamantan-1-yl)-N'-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}urea
N-(adamantan-1-yl)-N'-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}urea
Compound characteristics
| Compound ID: | E002-1521 |
| Compound Name: | N-(adamantan-1-yl)-N'-{5-[benzyl(methyl)amino]-1,3,4-thiadiazol-2-yl}urea |
| Molecular Weight: | 397.54 |
| Molecular Formula: | C21 H27 N5 O S |
| Smiles: | CN(Cc1ccccc1)c1nnc(NC(NC23CC4CC(CC(C4)C3)C2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.1895 |
| logD: | 5.1895 |
| logSw: | -5.1524 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.874 |
| InChI Key: | FILXYUUPPKHNIE-UHFFFAOYSA-N |