1-[4-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxypropan-2-yl 4-methoxybenzoate
Chemical Structure Depiction of
1-[4-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxypropan-2-yl 4-methoxybenzoate
1-[4-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxypropan-2-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 8009-2596 |
| Compound Name: | 1-[4-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxypropan-2-yl 4-methoxybenzoate |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C23 H27 N3 O6 S |
| Smiles: | COCC(CN1CCN(CC1)C1c2ccccc2S(N=1)(=O)=O)OC(c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1884 |
| logD: | 2.1876 |
| logSw: | -2.6654 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.837 |
| InChI Key: | YJOVBUCSGSAUFD-IBGZPJMESA-N |