2-(4-methylphenyl)-4-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
Chemical Structure Depiction of
2-(4-methylphenyl)-4-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
2-(4-methylphenyl)-4-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
Compound characteristics
| Compound ID: | D584-4856 |
| Compound Name: | 2-(4-methylphenyl)-4-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one |
| Molecular Weight: | 482.59 |
| Molecular Formula: | C28 H30 N6 O2 |
| Smiles: | Cc1ccc(cc1)c1nc2N(CC(N3CCN(CC3)c3cccc(C)c3)=O)C3CCCC=3C(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0558 |
| logD: | 4.0557 |
| logSw: | -4.072 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.603 |
| InChI Key: | WCUJLZQPAMSFGO-UHFFFAOYSA-N |