4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(3-methylphenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(3-methylphenyl)-3-nitrobenzamide
4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(3-methylphenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K784-1417 |
| Compound Name: | 4-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-N-(3-methylphenyl)-3-nitrobenzamide |
| Molecular Weight: | 508.02 |
| Molecular Formula: | C27 H30 Cl N5 O3 |
| Smiles: | Cc1cccc(c1)NC(c1ccc(c(c1)[N+]([O-])=O)NCCCN1CCN(CC1)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3714 |
| logD: | 5.1711 |
| logSw: | -5.8487 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.031 |
| InChI Key: | XXGSIXWRXSDLAM-UHFFFAOYSA-N |