7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | 8004-2162 |
| Compound Name: | 7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 352.41 |
| Molecular Formula: | C18 H16 N4 O2 S |
| Smiles: | CC1(C)Cc2c3C(N(c4ccccc4)c4nncn4c3sc2CO1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7786 |
| logD: | 2.7786 |
| logSw: | -3.0453 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.911 |
| InChI Key: | KRAQBUMHVGFVKU-UHFFFAOYSA-N |