6-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzoxazin-3(4H)-one
6-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | Y041-6957 |
| Compound Name: | 6-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C20 H20 N2 O5 |
| Smiles: | COc1cc2CCN(Cc2cc1OC)C(c1ccc2c(c1)NC(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4636 |
| logD: | 1.4636 |
| logSw: | -2.3215 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.08 |
| InChI Key: | NAPNBQHKFCWUBE-UHFFFAOYSA-N |