methyl 4-(2-{4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl}acetamido)benzoate
methyl 4-(2-{4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | K940-2782 |
| Compound Name: | methyl 4-(2-{4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl}acetamido)benzoate |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C23 H28 N4 O5 |
| Smiles: | COC(c1ccc(cc1)NC(CN1CCN(CC1)CC(Nc1ccccc1OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9109 |
| logD: | 2.9103 |
| logSw: | -3.3825 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.917 |
| InChI Key: | HQULHWKOYTUGCJ-UHFFFAOYSA-N |