benzyl {[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
benzyl {[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}acetate
benzyl {[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8003-6077 |
| Compound Name: | benzyl {[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C23 H21 N3 O2 S2 |
| Smiles: | CN1CCc2c(C1)c(c(C#N)c(n2)SCC(=O)OCc1ccccc1)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.3826 |
| logD: | 4.3817 |
| logSw: | -4.6749 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.883 |
| InChI Key: | JGBQFJHYGXREKU-UHFFFAOYSA-N |