9-(difluoromethyl)-7-methyl-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
9-(difluoromethyl)-7-methyl-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
9-(difluoromethyl)-7-methyl-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: | D643-0132 |
| Compound Name: | 9-(difluoromethyl)-7-methyl-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: | 454.5 |
| Molecular Formula: | C22 H20 F2 N6 O S |
| Smiles: | Cc1cc(C(F)F)nc2c1c1c(c3nc(c4ccc(CN5CCCCC5)o4)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.4453 |
| logD: | 4.3903 |
| logSw: | -4.4716 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.794 |
| InChI Key: | ZBCZLJXAHWBKHE-UHFFFAOYSA-N |