2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0037 |
| Compound Name: | 2-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C23 H19 N7 O2 S |
| Smiles: | Cc1cc(C)nc2c1c1c(c3nc(c4cc(c5ccc(c(c5)OC)OC)n[nH]4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.3097 |
| logD: | 4.164 |
| logSw: | -4.5665 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.777 |
| InChI Key: | FGEMBTCRTKXCPW-UHFFFAOYSA-N |