N-(4-ethylphenyl)-2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]acetamide
N-(4-ethylphenyl)-2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | C265-0809 |
| Compound Name: | N-(4-ethylphenyl)-2-[4-(4-methylpiperidine-1-sulfonyl)-1-oxoisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 467.59 |
| Molecular Formula: | C25 H29 N3 O4 S |
| Smiles: | CCc1ccc(cc1)NC(CN1C=C(c2ccccc2C1=O)S(N1CCC(C)CC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8807 |
| logD: | 3.8807 |
| logSw: | -3.8516 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.061 |
| InChI Key: | PNFTZRSKAZTIMQ-UHFFFAOYSA-N |