diethyl [(pyridin-4-yl)methylidene]propanedioate--hydrogen chloride (1/1)
Chemical Structure Depiction of
diethyl [(pyridin-4-yl)methylidene]propanedioate--hydrogen chloride (1/1)
diethyl [(pyridin-4-yl)methylidene]propanedioate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8018-5575 |
| Compound Name: | diethyl [(pyridin-4-yl)methylidene]propanedioate--hydrogen chloride (1/1) |
| Molecular Weight: | 285.72 |
| Molecular Formula: | C13 H15 N O4 |
| Salt: | HCl |
| Smiles: | CCOC(C(=Cc1ccncc1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0313 |
| logD: | 2.0313 |
| logSw: | -1.773 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.174 |
| InChI Key: | CMRLNKVVIHIYMH-UHFFFAOYSA-N |