2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-1,2-benzothiazol-3(2H)-one
2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-1,2-benzothiazol-3(2H)-one
Compound characteristics
| Compound ID: | E022-0625 |
| Compound Name: | 2-{1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-1,2-benzothiazol-3(2H)-one |
| Molecular Weight: | 401.91 |
| Molecular Formula: | C20 H20 Cl N3 O2 S |
| Smiles: | CC(C(N1CCN(CC1)c1cccc(c1)[Cl])=O)N1C(c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4574 |
| logD: | 3.4574 |
| logSw: | -3.7131 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.708 |
| InChI Key: | GLOQOCJOMDLGCU-AWEZNQCLSA-N |