[4-(3-chlorobenzoyl)piperazin-1-yl](6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl)methanone
Chemical Structure Depiction of
[4-(3-chlorobenzoyl)piperazin-1-yl](6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl)methanone
[4-(3-chlorobenzoyl)piperazin-1-yl](6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl)methanone
Compound characteristics
| Compound ID: | S352-0079 |
| Compound Name: | [4-(3-chlorobenzoyl)piperazin-1-yl](6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazin-3-yl)methanone |
| Molecular Weight: | 451.91 |
| Molecular Formula: | C23 H22 Cl N5 O3 |
| Smiles: | C1CN(CCN1C(c1cccc(c1)[Cl])=O)C(c1c2COC(Cn2nn1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9014 |
| logD: | 1.9014 |
| logSw: | -2.6737 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.864 |
| InChI Key: | RARUXTGQQFWJAD-HXUWFJFHSA-N |