ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethylbenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethylbenzamido)thiophene-3-carboxylate
ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethylbenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | V012-2850 |
| Compound Name: | ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethylbenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 401.57 |
| Molecular Formula: | C23 H31 N O3 S |
| Smiles: | CCc1ccc(cc1)C(Nc1c(cc(C(C)CC(C)(C)C)s1)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6411 |
| logD: | 3.9814 |
| logSw: | -5.672 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.878 |
| InChI Key: | QNSUWTJRISETKI-HNNXBMFYSA-N |