4-({3-(methoxycarbonyl)-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}amino)-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-({3-(methoxycarbonyl)-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}amino)-4-oxobut-2-enoic acid
4-({3-(methoxycarbonyl)-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}amino)-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | Y502-9967 |
| Compound Name: | 4-({3-(methoxycarbonyl)-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}amino)-4-oxobut-2-enoic acid |
| Molecular Weight: | 387.45 |
| Molecular Formula: | C20 H21 N O5 S |
| Smiles: | CC(C)c1ccc(cc1)c1c(C(=O)OC)c(NC(/C=C/C(O)=O)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.6307 |
| logD: | 0.1724 |
| logSw: | -4.5462 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.468 |
| InChI Key: | KNWCZRXQURNYDN-UHFFFAOYSA-N |