4-({1-[(furan-2-yl)methyl]-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene}methyl)benzoic acid
Chemical Structure Depiction of
4-({1-[(furan-2-yl)methyl]-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene}methyl)benzoic acid
4-({1-[(furan-2-yl)methyl]-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene}methyl)benzoic acid
Compound characteristics
| Compound ID: | 4693-0544 |
| Compound Name: | 4-({1-[(furan-2-yl)methyl]-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene}methyl)benzoic acid |
| Molecular Weight: | 367.36 |
| Molecular Formula: | C20 H17 N O6 |
| Smiles: | CC1=C(/C(=C/c2ccc(cc2)C(O)=O)C(N1Cc1ccco1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9474 |
| logD: | -0.6594 |
| logSw: | -3.0106 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.267 |
| InChI Key: | FNFKPRUOPAVSKA-UHFFFAOYSA-N |