7-{[6,7-dimethoxy-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-{[6,7-dimethoxy-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one
7-{[6,7-dimethoxy-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | C199-0127 |
Compound Name: | 7-{[6,7-dimethoxy-2-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one |
Molecular Weight: | 491.56 |
Molecular Formula: | C27 H25 N O6 S |
Smiles: | CC1=CC(=O)Oc2cc(ccc12)OCC1c2cc(c(cc2CCN1C(c1cccs1)=O)OC)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9689 |
logD: | 3.9689 |
logSw: | -4.1605 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 59.999 |
InChI Key: | MXROWBCKQINANC-NRFANRHFSA-N |