N-[2-(4-chlorophenoxy)ethyl]-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitroaniline
Chemical Structure Depiction of
N-[2-(4-chlorophenoxy)ethyl]-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitroaniline
N-[2-(4-chlorophenoxy)ethyl]-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitroaniline
Compound characteristics
| Compound ID: | 3819-1340 |
| Compound Name: | N-[2-(4-chlorophenoxy)ethyl]-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-2-nitroaniline |
| Molecular Weight: | 531.03 |
| Molecular Formula: | C25 H27 Cl N4 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)c1ccc(c(c1)NCCOc1ccc(cc1)[Cl])[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8474 |
| logD: | 5.8474 |
| logSw: | -6.0691 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.086 |
| InChI Key: | VFNGJXCALPIRCO-UHFFFAOYSA-N |