2-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-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-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y503-4692 |
| Compound Name: | 2-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 546.44 |
| Molecular Formula: | C26 H20 Br N5 O2 S |
| Smiles: | Cc1cc(C)nc2c1c1c(c3nc(c4ccc(c(COc5ccc(cc5)[Br])c4)OC)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 6.579 |
| logD: | 6.4334 |
| logSw: | -6.1338 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.885 |
| InChI Key: | VJHUKBFKDOTQDT-UHFFFAOYSA-N |