methyl 2-{[4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine-1-carbonyl]amino}benzoate
methyl 2-{[4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | V004-6210 |
| Compound Name: | methyl 2-{[4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 541.57 |
| Molecular Formula: | C29 H30 F3 N3 O4 |
| Salt: | not_available |
| Smiles: | COC(c1ccccc1NC(N1CCN(CC1)CCOC(c1ccccc1)c1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5171 |
| logD: | 5.2259 |
| logSw: | -5.6403 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.605 |
| InChI Key: | ZSDUIHBWFIHDJG-SANMLTNESA-N |