N-(3-chloro-4-methylphenyl)-1-(6-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]pyrazine-3-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-1-(6-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]pyrazine-3-carbonyl)piperidine-4-carboxamide
N-(3-chloro-4-methylphenyl)-1-(6-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]pyrazine-3-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | S437-0724 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-1-(6-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]pyrazine-3-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 428.88 |
| Molecular Formula: | C20 H21 Cl N6 O3 |
| Smiles: | CC1=Cn2c(C(N1)=O)c(C(N1CCC(CC1)C(Nc1ccc(C)c(c1)[Cl])=O)=O)nn2 |
| Stereo: | ACHIRAL |
| logP: | 1.5573 |
| logD: | 1.1647 |
| logSw: | -2.6861 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.298 |
| InChI Key: | BREKQQKVAYIXTN-UHFFFAOYSA-N |