N-[(furan-2-yl)methyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
N-[(furan-2-yl)methyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide
Compound characteristics
| Compound ID: | V029-3952 |
| Compound Name: | N-[(furan-2-yl)methyl]-3,3-dimethyl-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}butanamide |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C21 H24 N4 O5 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(CCc1nc(c2cccc(c2)[N+]([O-])=O)no1)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8619 |
| logD: | 4.8619 |
| logSw: | -4.7305 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.374 |
| InChI Key: | CWKNGHVWPVHYBD-UHFFFAOYSA-N |