ethyl 5-(cyclopentylcarbamoyl)-2-(3,5-dinitrobenzamido)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(cyclopentylcarbamoyl)-2-(3,5-dinitrobenzamido)-4-methylthiophene-3-carboxylate
ethyl 5-(cyclopentylcarbamoyl)-2-(3,5-dinitrobenzamido)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8014-0920 |
| Compound Name: | ethyl 5-(cyclopentylcarbamoyl)-2-(3,5-dinitrobenzamido)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 490.49 |
| Molecular Formula: | C21 H22 N4 O8 S |
| Smiles: | CCOC(c1c(C)c(C(NC2CCCC2)=O)sc1NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9152 |
| logD: | -2.1233 |
| logSw: | -4.0943 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 135.145 |
| InChI Key: | NDSWRWIPHQUEAF-UHFFFAOYSA-N |