6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0533 |
| Compound Name: | 6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C25 H26 N6 O3 |
| Smiles: | COc1cccc(c1)n1c2c(C(N(CC(N3CCC(CC3)Cc3ccccc3)=O)C=N2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.9726 |
| logD: | 2.9726 |
| logSw: | -3.3362 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.823 |
| InChI Key: | UEEALSHISBZQMZ-UHFFFAOYSA-N |