methyl 3-(4-chloro-3-nitrobenzamido)-4-(4-ethylpiperazin-1-yl)benzoate
Chemical Structure Depiction of
methyl 3-(4-chloro-3-nitrobenzamido)-4-(4-ethylpiperazin-1-yl)benzoate
methyl 3-(4-chloro-3-nitrobenzamido)-4-(4-ethylpiperazin-1-yl)benzoate
Compound characteristics
| Compound ID: | F019-2059 |
| Compound Name: | methyl 3-(4-chloro-3-nitrobenzamido)-4-(4-ethylpiperazin-1-yl)benzoate |
| Molecular Weight: | 446.89 |
| Molecular Formula: | C21 H23 Cl N4 O5 |
| Smiles: | CCN1CCN(CC1)c1ccc(cc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7449 |
| logD: | 3.7449 |
| logSw: | -4.2967 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.575 |
| InChI Key: | QFKPZTJKTSLTFI-UHFFFAOYSA-N |