7-(3,4-dimethylphenyl)-8,9-dimethyl-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-(3,4-dimethylphenyl)-8,9-dimethyl-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
7-(3,4-dimethylphenyl)-8,9-dimethyl-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D472-0852 |
| Compound Name: | 7-(3,4-dimethylphenyl)-8,9-dimethyl-2-(thiophen-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 373.48 |
| Molecular Formula: | C21 H19 N5 S |
| Smiles: | Cc1ccc(cc1C)n1c(C)c(C)c2c1ncn1c2nc(c2cccs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2771 |
| logD: | 4.9187 |
| logSw: | -5.5682 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.836 |
| InChI Key: | QFKKWJGGDFRVKI-UHFFFAOYSA-N |