[4-(4-tert-butylbenzoyl)piperazin-1-yl][6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methanone
Chemical Structure Depiction of
[4-(4-tert-butylbenzoyl)piperazin-1-yl][6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methanone
[4-(4-tert-butylbenzoyl)piperazin-1-yl][6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methanone
Compound characteristics
| Compound ID: | S352-0899 |
| Compound Name: | [4-(4-tert-butylbenzoyl)piperazin-1-yl][6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl]methanone |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C28 H33 N5 O3 |
| Smiles: | Cc1ccc(cc1)C1Cn2c(CO1)c(C(N1CCN(CC1)C(c1ccc(cc1)C(C)(C)C)=O)=O)nn2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5362 |
| logD: | 3.5362 |
| logSw: | -3.2359 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.864 |
| InChI Key: | NEQIOBFRRGFFJT-XMMPIXPASA-N |