8,9-dimethyl-2-(3-methylphenyl)-7-[(pyridin-4-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
8,9-dimethyl-2-(3-methylphenyl)-7-[(pyridin-4-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
8,9-dimethyl-2-(3-methylphenyl)-7-[(pyridin-4-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D472-0010 |
| Compound Name: | 8,9-dimethyl-2-(3-methylphenyl)-7-[(pyridin-4-yl)methyl]-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 368.44 |
| Molecular Formula: | C22 H20 N6 |
| Smiles: | Cc1cccc(c1)c1nc2c3c(C)c(C)n(Cc4ccncc4)c3ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6736 |
| logD: | 3.2796 |
| logSw: | -3.9246 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.502 |
| InChI Key: | LIWWUUUKBNGSIH-UHFFFAOYSA-N |