2-(4-chlorophenyl)-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]ethan-1-one
2-(4-chlorophenyl)-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S352-0014 |
| Compound Name: | 2-(4-chlorophenyl)-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 465.94 |
| Molecular Formula: | C24 H24 Cl N5 O3 |
| Smiles: | C(C(N1CCN(CC1)C(c1c2COC(Cn2nn1)c1ccccc1)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1967 |
| logD: | 2.1967 |
| logSw: | -2.6455 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.337 |
| InChI Key: | FTVUYJZWPGAVDF-OAQYLSRUSA-N |