methyl 2-chloro-5-[5-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)furan-2-yl]benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-[5-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)furan-2-yl]benzoate
methyl 2-chloro-5-[5-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)furan-2-yl]benzoate
Compound characteristics
| Compound ID: | Y508-1319 |
| Compound Name: | methyl 2-chloro-5-[5-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)furan-2-yl]benzoate |
| Molecular Weight: | 359.76 |
| Molecular Formula: | C18 H14 Cl N O5 |
| Smiles: | CCOC(C(=C\c1ccc(c2ccc(c(c2)C(=O)OC)[Cl])o1)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5066 |
| logD: | 4.5066 |
| logSw: | -4.674 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.792 |
| InChI Key: | JIYHSPDOSJBSPR-UHFFFAOYSA-N |