3-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-5-(4-methoxyphenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-5-(4-methoxyphenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
3-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-5-(4-methoxyphenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-1739 |
| Compound Name: | 3-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]amino}-5-(4-methoxyphenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C23 H27 N3 O3 S |
| Smiles: | CC1=C(c2ccc(cc2)OC)S(N=C1NCCCN1CCc2ccccc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3653 |
| logD: | 2.6304 |
| logSw: | -3.5486 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.196 |
| InChI Key: | QXBDCVUHHPUSGY-UHFFFAOYSA-N |