N-[(4-methylphenyl)methyl]-N-[3-(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)phenyl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-N-[3-(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)phenyl]-4-nitrobenzamide
N-[(4-methylphenyl)methyl]-N-[3-(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)phenyl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | V021-9454 |
| Compound Name: | N-[(4-methylphenyl)methyl]-N-[3-(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)phenyl]-4-nitrobenzamide |
| Molecular Weight: | 516.6 |
| Molecular Formula: | C29 H32 N4 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN(C(c2ccc(cc2)[N+]([O-])=O)=O)c2cccc(CC(NCCN3CCOCC3)=O)c2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4019 |
| logD: | 3.3141 |
| logSw: | -3.5973 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.904 |
| InChI Key: | WJGPUKFNXCXZRO-UHFFFAOYSA-N |