N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({N-[(furan-2-yl)methyl]glycyl}amino)-5-nitrobenzamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({N-[(furan-2-yl)methyl]glycyl}amino)-5-nitrobenzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({N-[(furan-2-yl)methyl]glycyl}amino)-5-nitrobenzamide
Compound characteristics
| Compound ID: | C284-0090 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({N-[(furan-2-yl)methyl]glycyl}amino)-5-nitrobenzamide |
| Molecular Weight: | 452.42 |
| Molecular Formula: | C22 H20 N4 O7 |
| Smiles: | C(C(Nc1ccc(cc1C(Nc1ccc2c(c1)OCCO2)=O)[N+]([O-])=O)=O)NCc1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 1.497 |
| logD: | 1.4003 |
| logSw: | -2.4506 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.5 |
| InChI Key: | FNUDXDXUTXAKOH-UHFFFAOYSA-N |