2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethyl 4-propoxybenzoate
Chemical Structure Depiction of
2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethyl 4-propoxybenzoate
2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethyl 4-propoxybenzoate
Compound characteristics
| Compound ID: | Y202-9820 |
| Compound Name: | 2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethyl 4-propoxybenzoate |
| Molecular Weight: | 400.39 |
| Molecular Formula: | C19 H20 N4 O6 |
| Smiles: | CCCOc1ccc(cc1)C(=O)OCCN(C)c1ccc(c2c1non2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6071 |
| logD: | 4.6071 |
| logSw: | -4.2786 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 101.277 |
| InChI Key: | OAZXHHADZPEYRI-UHFFFAOYSA-N |