N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-4-oxopyridin-1(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-4-oxopyridin-1(4H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-4-oxopyridin-1(4H)-yl]acetamide
Compound characteristics
| Compound ID: | G862-0477 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-methoxy-2-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-4-oxopyridin-1(4H)-yl]acetamide |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C22 H22 N4 O5 S |
| Smiles: | Cc1ccnc(n1)SCC1=CC(C(=CN1CC(Nc1ccc2c(c1)OCCO2)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2782 |
| logD: | 1.2781 |
| logSw: | -2.4573 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.578 |
| InChI Key: | RIFUPQDYAXWKNA-UHFFFAOYSA-N |