2-{1-acetyl-4-[2-(azepan-1-yl)-2-oxoethyl]piperidin-4-yl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{1-acetyl-4-[2-(azepan-1-yl)-2-oxoethyl]piperidin-4-yl}-2,3-dihydro-1H-isoindol-1-one
2-{1-acetyl-4-[2-(azepan-1-yl)-2-oxoethyl]piperidin-4-yl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | D750-1111 |
| Compound Name: | 2-{1-acetyl-4-[2-(azepan-1-yl)-2-oxoethyl]piperidin-4-yl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C23 H31 N3 O3 |
| Smiles: | CC(N1CCC(CC1)(CC(N1CCCCCC1)=O)N1Cc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2775 |
| logD: | 2.2775 |
| logSw: | -2.7954 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.867 |
| InChI Key: | HRHJURVMVLBKPQ-UHFFFAOYSA-N |