2-(1,3-benzothiazol-2-yl)-5-[2-(4-hexanoylpiperazin-1-yl)ethyl]-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-5-[2-(4-hexanoylpiperazin-1-yl)ethyl]-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
2-(1,3-benzothiazol-2-yl)-5-[2-(4-hexanoylpiperazin-1-yl)ethyl]-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione
Compound characteristics
| Compound ID: | 6208-0073 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-5-[2-(4-hexanoylpiperazin-1-yl)ethyl]-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C26 H32 N6 O3 S |
| Smiles: | CCCCCC(N1CCN(CC1)CCN1C(C)=C2C(=CC1=O)NN(C2=O)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0145 |
| logD: | 3.0116 |
| logSw: | -3.2073 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.957 |
| InChI Key: | PWDYNBQZRITTAZ-UHFFFAOYSA-N |