N-(butan-2-yl)-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
Chemical Structure Depiction of
N-(butan-2-yl)-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
N-(butan-2-yl)-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | V025-9271 |
| Compound Name: | N-(butan-2-yl)-3-nitro-N-{2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}benzamide |
| Molecular Weight: | 439.43 |
| Molecular Formula: | C21 H21 N5 O6 |
| Salt: | not_available |
| Smiles: | CCC(C)N(CCc1nc(c2ccc(cc2)[N+]([O-])=O)no1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9017 |
| logD: | 4.9017 |
| logSw: | -4.6295 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 113.862 |
| InChI Key: | WFNPFBQJWPOMQP-AWEZNQCLSA-N |