3-[(4-methylphenyl)methyl]-6-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
3-[(4-methylphenyl)methyl]-6-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-[(4-methylphenyl)methyl]-6-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0006 |
| Compound Name: | 3-[(4-methylphenyl)methyl]-6-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 380.45 |
| Molecular Formula: | C20 H24 N6 O2 |
| Smiles: | CC1CCN(CC1)C(CN1C=Nc2c(C1=O)nnn2Cc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4893 |
| logD: | 1.4892 |
| logSw: | -1.9179 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.414 |
| InChI Key: | XVOWKMQCXXFPDU-UHFFFAOYSA-N |