4-methoxy-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}benzamide
Chemical Structure Depiction of
4-methoxy-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}benzamide
4-methoxy-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}benzamide
Compound characteristics
| Compound ID: | V029-1645 |
| Compound Name: | 4-methoxy-N-{2-methyl-1-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butyl}benzamide |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C21 H22 N4 O5 |
| Salt: | not_available |
| Smiles: | CCC(C)C(c1nc(c2cccc(c2)[N+]([O-])=O)no1)NC(c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0925 |
| logD: | 5.0925 |
| logSw: | -4.9289 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.606 |
| InChI Key: | YKXVRPDDVVWGFK-UHFFFAOYSA-N |