2-{[(6-bromonaphthalen-2-yl)oxy]methyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{[(6-bromonaphthalen-2-yl)oxy]methyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{[(6-bromonaphthalen-2-yl)oxy]methyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y500-7346 |
| Compound Name: | 2-{[(6-bromonaphthalen-2-yl)oxy]methyl}-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 490.38 |
| Molecular Formula: | C23 H16 Br N5 O S |
| Smiles: | Cc1cc(C)nc2c1c1c(c3nc(COc4ccc5cc(ccc5c4)[Br])nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.8233 |
| logD: | 5.6777 |
| logSw: | -6.1801 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.245 |
| InChI Key: | KOIISWFDSBAIQO-UHFFFAOYSA-N |