N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[N-(3-ethoxypropyl)glycyl]amino}-5-nitrobenzamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[N-(3-ethoxypropyl)glycyl]amino}-5-nitrobenzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[N-(3-ethoxypropyl)glycyl]amino}-5-nitrobenzamide
Compound characteristics
| Compound ID: | C284-0378 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[N-(3-ethoxypropyl)glycyl]amino}-5-nitrobenzamide |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C22 H26 N4 O7 |
| Smiles: | CCOCCCNCC(Nc1ccc(cc1C(Nc1ccc2c(c1)OCCO2)=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7892 |
| logD: | 0.6808 |
| logSw: | -2.4803 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.842 |
| InChI Key: | VWNUXPMBQUTJCL-UHFFFAOYSA-N |