methyl 4-[(2-cyano-4,5-diethoxyphenyl)carbamoyl]benzoate
Chemical Structure Depiction of
methyl 4-[(2-cyano-4,5-diethoxyphenyl)carbamoyl]benzoate
methyl 4-[(2-cyano-4,5-diethoxyphenyl)carbamoyl]benzoate
Compound characteristics
| Compound ID: | 8013-5698 |
| Compound Name: | methyl 4-[(2-cyano-4,5-diethoxyphenyl)carbamoyl]benzoate |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C20 H20 N2 O5 |
| Smiles: | CCOc1cc(C#N)c(cc1OCC)NC(c1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6954 |
| logD: | 2.1777 |
| logSw: | -3.1367 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.282 |
| InChI Key: | BXRBTUQEOLHQNW-UHFFFAOYSA-N |