N-[2-methyl-5-(morpholine-4-carbonyl)-3-nitrophenyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-methyl-5-(morpholine-4-carbonyl)-3-nitrophenyl]-3-nitrobenzamide
N-[2-methyl-5-(morpholine-4-carbonyl)-3-nitrophenyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8018-0220 |
| Compound Name: | N-[2-methyl-5-(morpholine-4-carbonyl)-3-nitrophenyl]-3-nitrobenzamide |
| Molecular Weight: | 414.37 |
| Molecular Formula: | C19 H18 N4 O7 |
| Smiles: | Cc1c(cc(cc1[N+]([O-])=O)C(N1CCOCC1)=O)NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9709 |
| logD: | 1.7412 |
| logSw: | -2.6998 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.651 |
| InChI Key: | NPQUJSCBTPDLEZ-UHFFFAOYSA-N |