4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(4-ethoxyphenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(4-ethoxyphenyl)-3-nitrobenzamide
4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(4-ethoxyphenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K784-1420 |
| Compound Name: | 4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(4-ethoxyphenyl)-3-nitrobenzamide |
| Molecular Weight: | 538.05 |
| Molecular Formula: | C28 H32 Cl N5 O4 |
| Smiles: | CCOc1ccc(cc1)NC(c1ccc(c(c1)[N+]([O-])=O)NCCCN1CCN(CC1)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3804 |
| logD: | 5.178 |
| logSw: | -5.8983 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.155 |
| InChI Key: | SQFSFDQFIWJCQG-UHFFFAOYSA-N |