7-cycloheptyl-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-cycloheptyl-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-cycloheptyl-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | D718-1257 |
| Compound Name: | 7-cycloheptyl-2-phenylpyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 359.43 |
| Molecular Formula: | C21 H21 N5 O |
| Smiles: | C1CCCC(CC1)N1C=CC2=C(C=Nc3nc(c4ccccc4)nn23)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.9826 |
| logD: | 3.9826 |
| logSw: | -4.0908 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.256 |
| InChI Key: | QLUDBYMFQKCLCS-UHFFFAOYSA-N |