7,9-dimethyl-2-{5-[(piperidin-1-yl)methyl]furan-2-yl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7,9-dimethyl-2-{5-[(piperidin-1-yl)methyl]furan-2-yl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7,9-dimethyl-2-{5-[(piperidin-1-yl)methyl]furan-2-yl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D643-0028 |
| Compound Name: | 7,9-dimethyl-2-{5-[(piperidin-1-yl)methyl]furan-2-yl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 418.52 |
| Molecular Formula: | C22 H22 N6 O S |
| Smiles: | Cc1cc(C)nc2c1c1c(c3nc(c4ccc(CN5CCCCC5)o4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.1922 |
| logD: | 4.0466 |
| logSw: | -4.3525 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.601 |
| InChI Key: | FBVXMRVMTYOUAL-UHFFFAOYSA-N |