5-(2H-1,3-benzodioxol-5-yl)-4-methoxy-7-methyl-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinoline--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-4-methoxy-7-methyl-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinoline--hydrogen chloride (1/1)
5-(2H-1,3-benzodioxol-5-yl)-4-methoxy-7-methyl-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinoline--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8020-8058 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-4-methoxy-7-methyl-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinoline--hydrogen chloride (1/1) |
| Molecular Weight: | 375.81 |
| Molecular Formula: | C19 H17 N O5 |
| Salt: | HCl |
| Smiles: | CC1Cc2cc3c(c(c2C(c2ccc4c(c2)OCO4)=N1)OC)OCO3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.936 |
| logD: | 1.2916 |
| logSw: | -4.3573 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.681 |
| InChI Key: | CTIBXYIGGPGWDP-JTQLQIEISA-N |