2-(4-chlorophenyl)-1-{4-[6-(4-methylphenyl)-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-(4-methylphenyl)-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-(4-methylphenyl)-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: | S352-0836 |
| Compound Name: | 2-(4-chlorophenyl)-1-{4-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 479.97 |
| Molecular Formula: | C25 H26 Cl N5 O3 |
| Smiles: | Cc1ccc(cc1)C1Cn2c(CO1)c(C(N1CCN(CC1)C(Cc1ccc(cc1)[Cl])=O)=O)nn2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6158 |
| logD: | 2.6158 |
| logSw: | -3.3724 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.337 |
| InChI Key: | FMGVGUXMEQVDPZ-JOCHJYFZSA-N |