N-[3-(2-methylpiperidin-1-yl)propyl]-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide
Chemical Structure Depiction of
N-[3-(2-methylpiperidin-1-yl)propyl]-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide
N-[3-(2-methylpiperidin-1-yl)propyl]-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide
Compound characteristics
| Compound ID: | G596-0238 |
| Compound Name: | N-[3-(2-methylpiperidin-1-yl)propyl]-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide |
| Molecular Weight: | 426.58 |
| Molecular Formula: | C23 H30 N4 O2 S |
| Smiles: | CC1CCCCN1CCCNC(CN1C(CSc2cccn2c2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5035 |
| logD: | -0.4029 |
| logSw: | -2.6713 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.053 |
| InChI Key: | QVZCIQQSKLIKLV-SFHVURJKSA-N |