3-[(4-methylphenyl)methyl]-6-(3-phenylprop-2-en-1-yl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
3-[(4-methylphenyl)methyl]-6-(3-phenylprop-2-en-1-yl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-[(4-methylphenyl)methyl]-6-(3-phenylprop-2-en-1-yl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0001 |
| Compound Name: | 3-[(4-methylphenyl)methyl]-6-(3-phenylprop-2-en-1-yl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C21 H19 N5 O |
| Smiles: | Cc1ccc(Cn2c3c(C(N(C/C=C/c4ccccc4)C=N3)=O)nn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3398 |
| logD: | 3.3398 |
| logSw: | -3.3452 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53 |
| InChI Key: | HIRSDRQJMSMLLS-UHFFFAOYSA-N |