methyl 5-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
methyl 5-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | 6228-1089 |
| Compound Name: | methyl 5-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}amino)-4-cyano-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 404.83 |
| Molecular Formula: | C17 H13 Cl N4 O4 S |
| Smiles: | Cc1c(C#N)c(NC(c2ccc(Cn3cc(cn3)[Cl])o2)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7847 |
| logD: | 0.9827 |
| logSw: | -3.7931 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.701 |
| InChI Key: | OEELJJUYHQCWHJ-UHFFFAOYSA-N |