1-(4-{2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-1,3-oxazole-4-carbonyl}piperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-1,3-oxazole-4-carbonyl}piperazin-1-yl)ethan-1-one
1-(4-{2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-1,3-oxazole-4-carbonyl}piperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V007-6480 |
| Compound Name: | 1-(4-{2-[([(2H-1,3-benzodioxol-5-yl)methyl]{[4-(trifluoromethyl)phenyl]methyl}amino)methyl]-1,3-oxazole-4-carbonyl}piperazin-1-yl)ethan-1-one |
| Molecular Weight: | 544.53 |
| Molecular Formula: | C27 H27 F3 N4 O5 |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)C(c1coc(CN(Cc2ccc(cc2)C(F)(F)F)Cc2ccc3c(c2)OCO3)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2053 |
| logD: | 3.2041 |
| logSw: | -3.1384 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.044 |
| InChI Key: | HWCHHAXYAUPXLZ-UHFFFAOYSA-N |