3-butyl-2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-butyl-2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-butyl-2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0770 |
| Compound Name: | 3-butyl-2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 400.52 |
| Molecular Formula: | C19 H20 N4 O2 S2 |
| Smiles: | CCCCN1C(=Nc2c3cccnc3sc2C1=O)SCc1c(C)noc1C |
| Stereo: | ACHIRAL |
| logP: | 4.1119 |
| logD: | 4.1118 |
| logSw: | -3.9144 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.96 |
| InChI Key: | RBQVPNYKKZUEKE-UHFFFAOYSA-N |