2-{[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
2-{[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | F383-0866 |
| Compound Name: | 2-{[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methoxyphenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C25 H28 N2 O5 S |
| Smiles: | COc1ccc(CN2C(C3CCCCC3C2=O)=O)cc1S(N1CCc2ccccc2C1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4667 |
| logD: | 3.4667 |
| logSw: | -3.6818 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.687 |
| InChI Key: | VCJIWJMUGSPGAK-UHFFFAOYSA-N |