5-(2-{5-[(4-chlorophenyl)sulfanyl]furan-2-yl}ethenyl)-3-methyl-4-nitro-1,2-oxazole
Chemical Structure Depiction of
5-(2-{5-[(4-chlorophenyl)sulfanyl]furan-2-yl}ethenyl)-3-methyl-4-nitro-1,2-oxazole
5-(2-{5-[(4-chlorophenyl)sulfanyl]furan-2-yl}ethenyl)-3-methyl-4-nitro-1,2-oxazole
Compound characteristics
| Compound ID: | 8241-0085 |
| Compound Name: | 5-(2-{5-[(4-chlorophenyl)sulfanyl]furan-2-yl}ethenyl)-3-methyl-4-nitro-1,2-oxazole |
| Molecular Weight: | 362.79 |
| Molecular Formula: | C16 H11 Cl N2 O4 S |
| Smiles: | Cc1c(c(/C=C/c2ccc(o2)Sc2ccc(cc2)[Cl])on1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4855 |
| logD: | 5.4855 |
| logSw: | -6.0612 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.324 |
| InChI Key: | IITKRJXXYONNLZ-UHFFFAOYSA-N |