N-(2-{benzyl[(furan-2-yl)methyl]amino}-2-oxoethyl)-2-chloro-N-(2-methylpropyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(2-{benzyl[(furan-2-yl)methyl]amino}-2-oxoethyl)-2-chloro-N-(2-methylpropyl)-4-nitrobenzamide
N-(2-{benzyl[(furan-2-yl)methyl]amino}-2-oxoethyl)-2-chloro-N-(2-methylpropyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | V001-4753 |
| Compound Name: | N-(2-{benzyl[(furan-2-yl)methyl]amino}-2-oxoethyl)-2-chloro-N-(2-methylpropyl)-4-nitrobenzamide |
| Molecular Weight: | 483.95 |
| Molecular Formula: | C25 H26 Cl N3 O5 |
| Smiles: | CC(C)CN(CC(N(Cc1ccccc1)Cc1ccco1)=O)C(c1ccc(cc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5833 |
| logD: | 4.5833 |
| logSw: | -4.8871 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.263 |
| InChI Key: | BSMXQYOICJKSFF-UHFFFAOYSA-N |