7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-6(7H)-one
Chemical Structure Depiction of
7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-6(7H)-one
7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-6(7H)-one
Compound characteristics
| Compound ID: | G596-0010 |
| Compound Name: | 7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrrolo[1,2-a][3,1,6]benzothiadiazocin-6(7H)-one |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C24 H24 N4 O2 S |
| Smiles: | C1CN(CCN1C(CN1C(CSc2cccn2c2ccccc12)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1926 |
| logD: | 3.1926 |
| logSw: | -3.3808 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.96 |
| InChI Key: | AKEXNFNVXWIRNK-UHFFFAOYSA-N |