7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | V005-2817 |
| Compound Name: | 7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 442.52 |
| Molecular Formula: | C25 H26 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2)c(N2CCN(CC2)Cc2ccc3c(c2)OCO3)n2c(ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.789 |
| logD: | 2.3561 |
| logSw: | -4.1079 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.959 |
| InChI Key: | MHZCJHMSTYRJQV-UHFFFAOYSA-N |