ethyl 3,7-bis(4-nitrobenzamido)-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 3,7-bis(4-nitrobenzamido)-1-benzothiophene-2-carboxylate
ethyl 3,7-bis(4-nitrobenzamido)-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8005-8965 |
| Compound Name: | ethyl 3,7-bis(4-nitrobenzamido)-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 534.5 |
| Molecular Formula: | C25 H18 N4 O8 S |
| Smiles: | CCOC(c1c(c2cccc(c2s1)NC(c1ccc(cc1)[N+]([O-])=O)=O)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6637 |
| logD: | 3.8511 |
| logSw: | -4.363 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 132.591 |
| InChI Key: | DGQUJHMISBUYDB-UHFFFAOYSA-N |