5-[4-(ethanesulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
Chemical Structure Depiction of
5-[4-(ethanesulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
5-[4-(ethanesulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline
Compound characteristics
| Compound ID: | 4299-1917 |
| Compound Name: | 5-[4-(ethanesulfonyl)piperazin-1-yl]-N-[(furan-2-yl)methyl]-2-nitroaniline |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C17 H22 N4 O5 S |
| Smiles: | CCS(N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5369 |
| logD: | 2.5369 |
| logSw: | -2.9391 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.742 |
| InChI Key: | OQBILIDQLOQRDB-UHFFFAOYSA-N |