2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C265-0734 |
| Compound Name: | 2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 529.61 |
| Molecular Formula: | C26 H31 N3 O7 S |
| Smiles: | CC1CCN(CC1)S(C1=CN(CC(Nc2cc(c(c(c2)OC)OC)OC)=O)C(c2ccccc12)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3306 |
| logD: | 2.3304 |
| logSw: | -3.2106 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.038 |
| InChI Key: | ALFMQAHKJARRFO-UHFFFAOYSA-N |