1-{4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}-2-(4-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}-2-(4-fluorophenyl)ethan-1-one
1-{4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}-2-(4-fluorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | S352-0321 |
| Compound Name: | 1-{4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}-2-(4-fluorophenyl)ethan-1-one |
| Molecular Weight: | 483.93 |
| Molecular Formula: | C24 H23 Cl F N5 O3 |
| Smiles: | C(C(N1CCN(CC1)C(c1c2COC(Cn2nn1)c1ccc(cc1)[Cl])=O)=O)c1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2215 |
| logD: | 2.2215 |
| logSw: | -2.957 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.337 |
| InChI Key: | WLZAEDCFCATCFT-NRFANRHFSA-N |