N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | E140-0879 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-[(4-fluorophenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 482.53 |
| Molecular Formula: | C24 H23 F N4 O4 S |
| Smiles: | C1CN(CC2=C1N=C(NC2=O)SCC(Nc1ccc2c(c1)OCCO2)=O)Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 1.5348 |
| logD: | 0.9854 |
| logSw: | -2.607 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.918 |
| InChI Key: | YHLAVRRKMUDZCJ-UHFFFAOYSA-N |