[3-(ethoxycarbonyl)-2-methyl-5-phenyl-1H-pyrrol-1-yl]acetic acid
Chemical Structure Depiction of
[3-(ethoxycarbonyl)-2-methyl-5-phenyl-1H-pyrrol-1-yl]acetic acid
[3-(ethoxycarbonyl)-2-methyl-5-phenyl-1H-pyrrol-1-yl]acetic acid
Compound characteristics
| Compound ID: | R052-2678 |
| Compound Name: | [3-(ethoxycarbonyl)-2-methyl-5-phenyl-1H-pyrrol-1-yl]acetic acid |
| Molecular Weight: | 287.31 |
| Molecular Formula: | C16 H17 N O4 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CC(O)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2711 |
| logD: | -2.1324 |
| logSw: | -2.8994 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.327 |
| InChI Key: | BNYIGLLVRXMHSH-UHFFFAOYSA-N |