N-[2-(4-chlorophenoxy)ethyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
Chemical Structure Depiction of
N-[2-(4-chlorophenoxy)ethyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
N-[2-(4-chlorophenoxy)ethyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
Compound characteristics
| Compound ID: | 2023-0573 |
| Compound Name: | N-[2-(4-chlorophenoxy)ethyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline |
| Molecular Weight: | 390.87 |
| Molecular Formula: | C19 H23 Cl N4 O3 |
| Smiles: | CN1CCN(CC1)c1ccc(c(c1)NCCOc1ccc(cc1)[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1794 |
| logD: | 3.6113 |
| logSw: | -4.5015 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.044 |
| InChI Key: | RARWAAHCGYBBFF-UHFFFAOYSA-N |