3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-methoxy-2H-1-benzopyran-2-one
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 4312-1596 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 335.36 |
| Molecular Formula: | C20 H17 N O4 |
| Smiles: | COc1ccc2c(C=C(C(N3CCc4ccccc4C3)=O)C(=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9618 |
| logD: | 2.9618 |
| logSw: | -3.3998 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.014 |
| InChI Key: | VJGMNDVRUXFTTC-UHFFFAOYSA-N |