7-[2-(3,4-diethoxyphenyl)ethyl]-2,8,9-trimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-[2-(3,4-diethoxyphenyl)ethyl]-2,8,9-trimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
7-[2-(3,4-diethoxyphenyl)ethyl]-2,8,9-trimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D472-0955 |
| Compound Name: | 7-[2-(3,4-diethoxyphenyl)ethyl]-2,8,9-trimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 393.49 |
| Molecular Formula: | C22 H27 N5 O2 |
| Smiles: | CCOc1ccc(CCn2c(C)c(C)c3c2ncn2c3nc(C)n2)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.8948 |
| logD: | 2.7338 |
| logSw: | -3.2597 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.357 |
| InChI Key: | SMXUOGAJAXUMHS-UHFFFAOYSA-N |