N-tert-butyl-2-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-tert-butyl-2-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
N-tert-butyl-2-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | V003-7231 |
| Compound Name: | N-tert-butyl-2-chloro-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-4-nitrobenzamide |
| Molecular Weight: | 558.03 |
| Molecular Formula: | C28 H32 Cl N3 O7 |
| Smiles: | CC(C)(C)N(CC(N(CCc1ccc(c(c1)OC)OC)Cc1ccco1)=O)C(c1ccc(cc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3147 |
| logD: | 4.3147 |
| logSw: | -4.7746 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.609 |
| InChI Key: | IMGKMSGLIZORBF-UHFFFAOYSA-N |