3-[(4-chlorophenyl)methyl]-6-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-6-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-[(4-chlorophenyl)methyl]-6-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0248 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-6-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 434.88 |
| Molecular Formula: | C22 H19 Cl N6 O2 |
| Smiles: | C1Cc2ccccc2N(C1)C(CN1C=Nc2c(C1=O)nnn2Cc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.454 |
| logD: | 2.454 |
| logSw: | -2.8624 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.079 |
| InChI Key: | HHZSFXWTLZAKOK-UHFFFAOYSA-N |