{4-[(2H-1,3-benzodioxol-5-yl)amino]-7-methyl-1,8-naphthyridin-3-yl}(thiomorpholin-4-yl)methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)amino]-7-methyl-1,8-naphthyridin-3-yl}(thiomorpholin-4-yl)methanone--hydrogen chloride (1/1)
{4-[(2H-1,3-benzodioxol-5-yl)amino]-7-methyl-1,8-naphthyridin-3-yl}(thiomorpholin-4-yl)methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | L968-0539 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)amino]-7-methyl-1,8-naphthyridin-3-yl}(thiomorpholin-4-yl)methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Salt: | HCl |
| Smiles: | Cc1ccc2c(c(cnc2n1)C(N1CCSCC1)=O)Nc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.9418 |
| logD: | 2.941 |
| logSw: | -3.2037 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.12 |
| InChI Key: | XJGGCOIZLZPSOT-UHFFFAOYSA-N |