4-(3-methoxyanilino)-3,5-dinitro-N-[4-(octyloxy)phenyl]benzamide
Chemical Structure Depiction of
4-(3-methoxyanilino)-3,5-dinitro-N-[4-(octyloxy)phenyl]benzamide
4-(3-methoxyanilino)-3,5-dinitro-N-[4-(octyloxy)phenyl]benzamide
Compound characteristics
| Compound ID: | 8006-4264 |
| Compound Name: | 4-(3-methoxyanilino)-3,5-dinitro-N-[4-(octyloxy)phenyl]benzamide |
| Molecular Weight: | 536.58 |
| Molecular Formula: | C28 H32 N4 O7 |
| Smiles: | CCCCCCCCOc1ccc(cc1)NC(c1cc(c(c(c1)[N+]([O-])=O)Nc1cccc(c1)OC)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.8494 |
| logD: | 7.8089 |
| logSw: | -5.6624 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.969 |
| InChI Key: | JMLPQQSQCHTLQN-UHFFFAOYSA-N |