3-methyl-4-nitro-5-{2-[4-(pyrrolidin-1-yl)phenyl]ethenyl}-1,2-oxazole
Chemical Structure Depiction of
3-methyl-4-nitro-5-{2-[4-(pyrrolidin-1-yl)phenyl]ethenyl}-1,2-oxazole
3-methyl-4-nitro-5-{2-[4-(pyrrolidin-1-yl)phenyl]ethenyl}-1,2-oxazole
Compound characteristics
| Compound ID: | 8241-0096 |
| Compound Name: | 3-methyl-4-nitro-5-{2-[4-(pyrrolidin-1-yl)phenyl]ethenyl}-1,2-oxazole |
| Molecular Weight: | 299.33 |
| Molecular Formula: | C16 H17 N3 O3 |
| Smiles: | Cc1c(c(/C=C/c2ccc(cc2)N2CCCC2)on1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9109 |
| logD: | 3.9109 |
| logSw: | -4.0804 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.352 |
| InChI Key: | OKJTUQMZPORLOR-UHFFFAOYSA-N |