8,8-dimethyl-2,3-diphenyl-3,6,8,9-tetrahydro-10H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidin-10-one
Chemical Structure Depiction of
8,8-dimethyl-2,3-diphenyl-3,6,8,9-tetrahydro-10H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidin-10-one
8,8-dimethyl-2,3-diphenyl-3,6,8,9-tetrahydro-10H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidin-10-one
Compound characteristics
| Compound ID: | 8640-0039 |
| Compound Name: | 8,8-dimethyl-2,3-diphenyl-3,6,8,9-tetrahydro-10H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidin-10-one |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C24 H20 N4 O2 S |
| Smiles: | CC1(C)Cc2c3C(N4C(=Nc3sc2CO1)N(C(c1ccccc1)=N4)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5218 |
| logD: | 4.2481 |
| logSw: | -4.6053 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.895 |
| InChI Key: | ZVQCDYYEABWZJY-UHFFFAOYSA-N |