1-(3-{[7-methyl-3-(thiomorpholine-4-carbonyl)-1,8-naphthyridin-4-yl]amino}phenyl)ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(3-{[7-methyl-3-(thiomorpholine-4-carbonyl)-1,8-naphthyridin-4-yl]amino}phenyl)ethan-1-one--hydrogen chloride (1/1)
1-(3-{[7-methyl-3-(thiomorpholine-4-carbonyl)-1,8-naphthyridin-4-yl]amino}phenyl)ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | L968-0475 |
| Compound Name: | 1-(3-{[7-methyl-3-(thiomorpholine-4-carbonyl)-1,8-naphthyridin-4-yl]amino}phenyl)ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 442.97 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Salt: | HCl |
| Smiles: | CC(c1cccc(c1)Nc1c(cnc2c1ccc(C)n2)C(N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8496 |
| logD: | 2.8488 |
| logSw: | -3.1618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.831 |
| InChI Key: | XBKYSNNEPNDSQB-UHFFFAOYSA-N |