(6S)-3-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-6-(2-methylpropyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
Chemical Structure Depiction of
(6S)-3-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-6-(2-methylpropyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
(6S)-3-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-6-(2-methylpropyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one
Compound characteristics
| Compound ID: | SD69-0494 |
| Compound Name: | (6S)-3-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-6-(2-methylpropyl)-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-4(5H)-one |
| Molecular Weight: | 410.52 |
| Molecular Formula: | C22 H30 N6 O2 |
| Smiles: | CC(C)C[C@H]1Cn2c(C(N1)=O)c(C(N1CCN(CC1)Cc1ccc(C)cc1)=O)nn2 |
| Stereo: | ABSOLUTE |
| logP: | 1.7401 |
| logD: | 1.6882 |
| logSw: | -2.3551 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.141 |
| InChI Key: | YNGRIVNWRGGZHV-SFHVURJKSA-N |