methyl 4-(4-ethylpiperazin-1-yl)-3-(2-nitrobenzamido)benzoate
Chemical Structure Depiction of
methyl 4-(4-ethylpiperazin-1-yl)-3-(2-nitrobenzamido)benzoate
methyl 4-(4-ethylpiperazin-1-yl)-3-(2-nitrobenzamido)benzoate
Compound characteristics
| Compound ID: | F019-2170 |
| Compound Name: | methyl 4-(4-ethylpiperazin-1-yl)-3-(2-nitrobenzamido)benzoate |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C21 H24 N4 O5 |
| Smiles: | CCN1CCN(CC1)c1ccc(cc1NC(c1ccccc1[N+]([O-])=O)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2185 |
| logD: | 3.2185 |
| logSw: | -3.7426 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.575 |
| InChI Key: | OFBHQIUKAYGLCS-UHFFFAOYSA-N |