2-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y500-9452 |
| Compound Name: | 2-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 567.01 |
| Molecular Formula: | C23 H18 Cl F3 N6 O2 S2 |
| Smiles: | Cc1cc(C(F)(F)F)nc2c1c1c(c3nc(C4CCN(CC4)S(c4ccc(cc4)[Cl])(=O)=O)nn3cn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.5764 |
| logD: | 5.5739 |
| logSw: | -6.1104 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.931 |
| InChI Key: | IPEGJUOKHGKRKS-UHFFFAOYSA-N |