2-(4-tert-butylphenyl)-8,9-dimethyl-7-[(pyridin-3-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-8,9-dimethyl-7-[(pyridin-3-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-(4-tert-butylphenyl)-8,9-dimethyl-7-[(pyridin-3-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D472-0002 |
| Compound Name: | 2-(4-tert-butylphenyl)-8,9-dimethyl-7-[(pyridin-3-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 410.52 |
| Molecular Formula: | C25 H26 N6 |
| Smiles: | Cc1c2c(ncn3c2nc(c2ccc(cc2)C(C)(C)C)n3)n(Cc2cccnc2)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.1422 |
| logD: | 4.6419 |
| logSw: | -5.0108 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.592 |
| InChI Key: | VLAKGHFAVREPDP-UHFFFAOYSA-N |