N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C200-3374 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 489.51 |
| Molecular Formula: | C25 H19 N3 O6 S |
| Smiles: | C(c1ccco1)N1C(=Nc2c3ccccc3oc2C1=O)SCC(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4643 |
| logD: | 3.4643 |
| logSw: | -3.8979 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.388 |
| InChI Key: | NKKQKCKGUFSPAF-UHFFFAOYSA-N |