3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-5-(thiophen-2-yl)-1H-pyrrol-2-yl}propanoic acid
Chemical Structure Depiction of
3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-5-(thiophen-2-yl)-1H-pyrrol-2-yl}propanoic acid
3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-5-(thiophen-2-yl)-1H-pyrrol-2-yl}propanoic acid
Compound characteristics
| Compound ID: | D135-0124 |
| Compound Name: | 3-{1-[2-(3-methoxyanilino)-2-oxoethyl]-5-(thiophen-2-yl)-1H-pyrrol-2-yl}propanoic acid |
| Molecular Weight: | 384.45 |
| Molecular Formula: | C20 H20 N2 O4 S |
| Smiles: | COc1cccc(c1)NC(Cn1c(CCC(O)=O)ccc1c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7885 |
| logD: | 0.9747 |
| logSw: | -3.9976 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.748 |
| InChI Key: | RIPKZJBHPVJDFJ-UHFFFAOYSA-N |