5-[(4-tert-butylphenyl)methoxy]-2-({4-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperazin-1-yl}methyl)-4H-pyran-4-one
Chemical Structure Depiction of
5-[(4-tert-butylphenyl)methoxy]-2-({4-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperazin-1-yl}methyl)-4H-pyran-4-one
5-[(4-tert-butylphenyl)methoxy]-2-({4-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperazin-1-yl}methyl)-4H-pyran-4-one
Compound characteristics
| Compound ID: | V003-1847 |
| Compound Name: | 5-[(4-tert-butylphenyl)methoxy]-2-({4-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperazin-1-yl}methyl)-4H-pyran-4-one |
| Molecular Weight: | 594.08 |
| Molecular Formula: | C32 H33 Cl F N3 O5 |
| Salt: | not_available |
| Smiles: | Cc1c(C(N2CCN(CC2)CC2=CC(C(=CO2)OCc2ccc(cc2)C(C)(C)C)=O)=O)c(c2c(cccc2[Cl])F)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.1024 |
| logD: | 5.102 |
| logSw: | -5.6337 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.299 |
| InChI Key: | IMIAXGIPIXFWGT-UHFFFAOYSA-N |