N-[2-(morpholin-4-yl)ethyl]-N-(pyrrolidin-3-yl)-N'-{[4-(trifluoromethoxy)phenyl]methyl}urea--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(morpholin-4-yl)ethyl]-N-(pyrrolidin-3-yl)-N'-{[4-(trifluoromethoxy)phenyl]methyl}urea--hydrogen chloride (1/1)
N-[2-(morpholin-4-yl)ethyl]-N-(pyrrolidin-3-yl)-N'-{[4-(trifluoromethoxy)phenyl]methyl}urea--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | SB91-0173 |
| Compound Name: | N-[2-(morpholin-4-yl)ethyl]-N-(pyrrolidin-3-yl)-N'-{[4-(trifluoromethoxy)phenyl]methyl}urea--hydrogen chloride (1/1) |
| Molecular Weight: | 452.9 |
| Molecular Formula: | C19 H27 F3 N4 O3 |
| Salt: | HCl |
| Smiles: | C1CNCC1N(CCN1CCOCC1)C(NCc1ccc(cc1)OC(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7464 |
| logD: | -2.657 |
| logSw: | -2.0023 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.629 |
| InChI Key: | UQGCUWHNNIKHAV-INIZCTEOSA-N |