2-[(benzyl{3-[(furan-2-yl)methoxy]-2-hydroxypropyl}amino)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[(benzyl{3-[(furan-2-yl)methoxy]-2-hydroxypropyl}amino)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-[(benzyl{3-[(furan-2-yl)methoxy]-2-hydroxypropyl}amino)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V016-9973 |
| Compound Name: | 2-[(benzyl{3-[(furan-2-yl)methoxy]-2-hydroxypropyl}amino)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C26 H29 N3 O4 S |
| Salt: | not_available |
| Smiles: | C1CCc2c(C1)c1C(NC(CN(CC(COCc3ccco3)O)Cc3ccccc3)=Nc1s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8096 |
| logD: | 3.8055 |
| logSw: | -4.279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.238 |
| InChI Key: | VYCQSEUSLPZUPA-IBGZPJMESA-N |