methyl 3-{[6,7-dimethoxy-1-(2-methoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[6,7-dimethoxy-1-(2-methoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}thiophene-2-carboxylate
methyl 3-{[6,7-dimethoxy-1-(2-methoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G525-0156 |
| Compound Name: | methyl 3-{[6,7-dimethoxy-1-(2-methoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}thiophene-2-carboxylate |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C21 H24 N2 O7 S |
| Smiles: | COC(CC1c2cc(c(cc2CCN1C(Nc1ccsc1C(=O)OC)=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3499 |
| logD: | 2.3486 |
| logSw: | -3.1633 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.24 |
| InChI Key: | OWGFDVROIJGYET-HNNXBMFYSA-N |