7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G857-2295 |
| Compound Name: | 7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 367.41 |
| Molecular Formula: | C18 H21 N7 O2 |
| Smiles: | CCn1c2c(c(ncn2)N2CCN(CC2)Cc2ccc3c(c2)OCO3)nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.7497 |
| logD: | 1.3004 |
| logSw: | -2.1153 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.141 |
| InChI Key: | XYLCPBVBSAJPKM-UHFFFAOYSA-N |