2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-3-(2-methylpropyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-3-(2-methylpropyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-3-(2-methylpropyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0805 |
| Compound Name: | 2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-3-(2-methylpropyl)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: | CC(C)CN1C(=Nc2c3cccnc3sc2C1=O)SCc1c(C)noc1C |
| Stereo: | ACHIRAL |
| logP: | 4.0896 |
| logD: | 4.0896 |
| logSw: | -4.1309 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.981 |
| InChI Key: | QKBNDMPUPNLCPG-UHFFFAOYSA-N |