7-({6,7-dimethoxy-2-[(thiophen-2-yl)acetyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-({6,7-dimethoxy-2-[(thiophen-2-yl)acetyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)-4-methyl-2H-1-benzopyran-2-one
7-({6,7-dimethoxy-2-[(thiophen-2-yl)acetyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C199-0102 |
| Compound Name: | 7-({6,7-dimethoxy-2-[(thiophen-2-yl)acetyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 505.59 |
| Molecular Formula: | C28 H27 N O6 S |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)OCC1c2cc(c(cc2CCN1C(Cc1cccs1)=O)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6717 |
| logD: | 3.6717 |
| logSw: | -3.9882 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.472 |
| InChI Key: | VITFFLDNCKEWBH-QHCPKHFHSA-N |