N-[2-(4-ethylphenoxy)ethyl]-5-(3-methylpiperazin-1-yl)-2-nitroaniline
Chemical Structure Depiction of
N-[2-(4-ethylphenoxy)ethyl]-5-(3-methylpiperazin-1-yl)-2-nitroaniline
N-[2-(4-ethylphenoxy)ethyl]-5-(3-methylpiperazin-1-yl)-2-nitroaniline
Compound characteristics
Compound ID: | 8006-2419 |
Compound Name: | N-[2-(4-ethylphenoxy)ethyl]-5-(3-methylpiperazin-1-yl)-2-nitroaniline |
Molecular Weight: | 384.48 |
Molecular Formula: | C21 H28 N4 O3 |
Smiles: | CCc1ccc(cc1)OCCNc1cc(ccc1[N+]([O-])=O)N1CCNC(C)C1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9917 |
logD: | 2.0414 |
logSw: | -4.0631 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 65.112 |
InChI Key: | DUCMTCXRNAFIQO-INIZCTEOSA-N |