5-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
5-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | E565-0996 |
| Compound Name: | 5-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)-3-[4-(propan-2-yl)benzene-1-sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 515.66 |
| Molecular Formula: | C27 H25 N5 O2 S2 |
| Smiles: | CC(C)c1ccc(cc1)S(c1c2nc(c3c(ccs3)n2nn1)N1CCC(=CC1)c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.745 |
| logD: | 6.745 |
| logSw: | -5.9706 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.875 |
| InChI Key: | ZKTQTSZRZZJFSO-UHFFFAOYSA-N |