N-(1-benzylpiperidin-4-yl)-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide
N-(1-benzylpiperidin-4-yl)-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide
Compound characteristics
Compound ID: | G596-0155 |
Compound Name: | N-(1-benzylpiperidin-4-yl)-2-(6-oxo-5,6-dihydro-7H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-7-yl)acetamide |
Molecular Weight: | 460.6 |
Molecular Formula: | C26 H28 N4 O2 S |
Smiles: | C1CN(CCC1NC(CN1C(CSc2cccn2c2ccccc12)=O)=O)Cc1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.3319 |
logD: | 1.7742 |
logSw: | -3.5597 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.044 |
InChI Key: | BHYVKJKQTYIHFF-UHFFFAOYSA-N |