2,2-dimethyl-10-(methylsulfanyl)-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Chemical Structure Depiction of
2,2-dimethyl-10-(methylsulfanyl)-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
2,2-dimethyl-10-(methylsulfanyl)-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Compound characteristics
| Compound ID: | 8640-0704 |
| Compound Name: | 2,2-dimethyl-10-(methylsulfanyl)-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C21 H19 N3 O2 S2 |
| Smiles: | CC1(C)Cc2c(CO1)c(c1ccccc1)nc1c2c2c(C(NC(=N2)SC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.6064 |
| logD: | 4.5933 |
| logSw: | -4.6859 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.357 |
| InChI Key: | UIUVXIGPKILQDD-UHFFFAOYSA-N |