N-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
N-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline
Compound characteristics
| Compound ID: | 8010-5700 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-2-nitroaniline |
| Molecular Weight: | 360.84 |
| Molecular Formula: | C18 H21 Cl N4 O2 |
| Smiles: | CN1CCN(CC1)c1ccc(c(c1)NCc1ccc(cc1)[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5013 |
| logD: | 2.9332 |
| logSw: | -3.9632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.785 |
| InChI Key: | MDKRJVYHNBQWOY-UHFFFAOYSA-N |