2-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
2-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]-1,2-benzothiazol-3(2H)-one
2-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]-1,2-benzothiazol-3(2H)-one
Compound characteristics
| Compound ID: | E022-0927 |
| Compound Name: | 2-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]-1,2-benzothiazol-3(2H)-one |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C21 H23 N3 O2 S |
| Smiles: | CCC(C(N1CCN(CC1)c1ccccc1)=O)N1C(c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5086 |
| logD: | 3.5085 |
| logSw: | -3.637 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.293 |
| InChI Key: | SKGMHATYYFFGBQ-SFHVURJKSA-N |