1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(5,7-diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(5,7-diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(5,7-diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | D530-0014 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(5,7-diphenyltetrazolo[1,5-a]pyrimidin-4(7H)-yl)ethan-1-one |
| Molecular Weight: | 448.53 |
| Molecular Formula: | C27 H24 N6 O |
| Smiles: | C1CN(Cc2ccccc12)C(CN1C(=CC(c2ccccc2)n2c1nnn2)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4284 |
| logD: | 4.4284 |
| logSw: | -4.3288 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 56.651 |
| InChI Key: | KETZKNVZGGZXNE-RUZDIDTESA-N |