N-[6-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-1,3-benzothiazol-2-yl]acetamide
Chemical Structure Depiction of
N-[6-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-1,3-benzothiazol-2-yl]acetamide
N-[6-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-1,3-benzothiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | F222-0438 |
| Compound Name: | N-[6-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-1,3-benzothiazol-2-yl]acetamide |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C24 H26 N4 O4 S |
| Smiles: | CC(Nc1nc2ccc(CCC(N3CCN(CC3)Cc3ccc4c(c3)OCO4)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0118 |
| logD: | 2.6676 |
| logSw: | -3.2776 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.038 |
| InChI Key: | MEVBMBXNRXNHFC-UHFFFAOYSA-N |