methyl 5-({5-[(4-chlorophenoxy)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-({5-[(4-chlorophenoxy)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
methyl 5-({5-[(4-chlorophenoxy)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y508-6083 |
| Compound Name: | methyl 5-({5-[(4-chlorophenoxy)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 430.86 |
| Molecular Formula: | C20 H15 Cl N2 O5 S |
| Smiles: | Cc1c(C#N)c(NC(c2ccc(COc3ccc(cc3)[Cl])o2)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.4477 |
| logD: | 2.6457 |
| logSw: | -4.87 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.423 |
| InChI Key: | HJSKDKMALKQCRF-UHFFFAOYSA-N |