N-(4-chloro-3-methylphenyl)-1-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(4-chloro-3-methylphenyl)-1-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperidine-4-carboxamide
N-(4-chloro-3-methylphenyl)-1-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | S353-1422 |
| Compound Name: | N-(4-chloro-3-methylphenyl)-1-[6-(4-methylphenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperidine-4-carboxamide |
| Molecular Weight: | 493.99 |
| Molecular Formula: | C26 H28 Cl N5 O3 |
| Smiles: | Cc1ccc(cc1)C1Cn2c(CO1)c(C(N1CCC(CC1)C(Nc1ccc(c(C)c1)[Cl])=O)=O)nn2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4963 |
| logD: | 3.496 |
| logSw: | -3.795 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.499 |
| InChI Key: | MGSCEBYURXRTHX-HSZRJFAPSA-N |