methyl 4-methyl-2-{[1-oxo-2-(propan-2-yl)-1,2-dihydroisoquinoline-4-carbonyl]amino}-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
methyl 4-methyl-2-{[1-oxo-2-(propan-2-yl)-1,2-dihydroisoquinoline-4-carbonyl]amino}-1,3-thiazole-5-carboxylate
methyl 4-methyl-2-{[1-oxo-2-(propan-2-yl)-1,2-dihydroisoquinoline-4-carbonyl]amino}-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | Y042-5757 |
| Compound Name: | methyl 4-methyl-2-{[1-oxo-2-(propan-2-yl)-1,2-dihydroisoquinoline-4-carbonyl]amino}-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 385.44 |
| Molecular Formula: | C19 H19 N3 O4 S |
| Smiles: | CC(C)N1C=C(C(Nc2nc(C)c(C(=O)OC)s2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.6986 |
| logD: | 0.7048 |
| logSw: | -3.5175 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.246 |
| InChI Key: | NITXWEMVEMPUMM-UHFFFAOYSA-N |