5-[(4-tert-butylphenyl)methoxy]-2-[(4-{1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carbonyl}piperazin-1-yl)methyl]-4H-pyran-4-one
Chemical Structure Depiction of
5-[(4-tert-butylphenyl)methoxy]-2-[(4-{1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carbonyl}piperazin-1-yl)methyl]-4H-pyran-4-one
5-[(4-tert-butylphenyl)methoxy]-2-[(4-{1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carbonyl}piperazin-1-yl)methyl]-4H-pyran-4-one
Compound characteristics
| Compound ID: | V008-4030 |
| Compound Name: | 5-[(4-tert-butylphenyl)methoxy]-2-[(4-{1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carbonyl}piperazin-1-yl)methyl]-4H-pyran-4-one |
| Molecular Weight: | 613.68 |
| Molecular Formula: | C32 H38 F3 N5 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(COC2=COC(CN3CCN(CC3)C(C3CCN(CC3)c3nccc(C(F)(F)F)n3)=O)=CC2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9229 |
| logD: | 4.9217 |
| logSw: | -4.6951 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.722 |
| InChI Key: | LWUOHRXVBVMCEV-UHFFFAOYSA-N |