methyl 4-[(4-methylpiperazine-1-sulfonyl)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(4-methylpiperazine-1-sulfonyl)methyl]benzoate
methyl 4-[(4-methylpiperazine-1-sulfonyl)methyl]benzoate
Compound characteristics
| Compound ID: | Y300-2251 |
| Compound Name: | methyl 4-[(4-methylpiperazine-1-sulfonyl)methyl]benzoate |
| Molecular Weight: | 312.39 |
| Molecular Formula: | C14 H20 N2 O4 S |
| Smiles: | CN1CCN(CC1)S(Cc1ccc(cc1)C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8816 |
| logD: | 0.832 |
| logSw: | -2.0463 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 56.494 |
| InChI Key: | MQHDIGIFFQPADF-UHFFFAOYSA-N |