N-[(3-chlorophenyl)methyl]-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-chlorophenyl)methyl]-1-(6-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]pyrazine-3-carbonyl)piperidine-4-carboxamide
N-[(3-chlorophenyl)methyl]-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: | S437-0611 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-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(NCc1cccc(c1)[Cl])=O)=O)nn2 |
| Stereo: | ACHIRAL |
| logP: | 0.5533 |
| logD: | 0.1606 |
| logSw: | -2.4815 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.62 |
| InChI Key: | AQWAHCAGHPSBHT-UHFFFAOYSA-N |