ethyl 5-{5-[4-(4-nitrophenyl)piperazine-1-sulfonyl]thiophen-2-yl}-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{5-[4-(4-nitrophenyl)piperazine-1-sulfonyl]thiophen-2-yl}-1,2-oxazole-3-carboxylate
ethyl 5-{5-[4-(4-nitrophenyl)piperazine-1-sulfonyl]thiophen-2-yl}-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | G310-0069 |
| Compound Name: | ethyl 5-{5-[4-(4-nitrophenyl)piperazine-1-sulfonyl]thiophen-2-yl}-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 492.53 |
| Molecular Formula: | C20 H20 N4 O7 S2 |
| Smiles: | CCOC(c1cc(c2ccc(s2)S(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)(=O)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7985 |
| logD: | 3.7985 |
| logSw: | -3.8169 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 111.898 |
| InChI Key: | DGYJVAXGNLAJRD-UHFFFAOYSA-N |