2-[(adamantan-1-yl)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-[(adamantan-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(adamantan-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y503-4531 |
| Compound Name: | 2-[(adamantan-1-yl)methyl]-7,9-dimethylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 403.55 |
| Molecular Formula: | C23 H25 N5 S |
| Smiles: | Cc1cc(C)nc2c1c1c(c3nc(CC45CC6CC(CC(C6)C5)C4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.6426 |
| logD: | 5.497 |
| logSw: | -5.882 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.051 |
| InChI Key: | OTBYMWVNHPSVFI-UHFFFAOYSA-N |