2,2-dimethyl-10-(methylsulfanyl)-5-(propan-2-yl)-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-(propan-2-yl)-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-(propan-2-yl)-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: | 8640-0688 |
| Compound Name: | 2,2-dimethyl-10-(methylsulfanyl)-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one |
| Molecular Weight: | 375.51 |
| Molecular Formula: | C18 H21 N3 O2 S2 |
| Smiles: | CC(C)c1c2COC(C)(C)Cc2c2c3c(C(NC(=N3)SC)=O)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.602 |
| logD: | 4.5888 |
| logSw: | -4.5378 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.629 |
| InChI Key: | RXYNQRNZBLGJDN-UHFFFAOYSA-N |