3-(5-{[(5-{[(furan-2-yl)methyl]carbamoyl}-1-methyl-1H-pyrazol-4-yl)imino]methyl}furan-2-yl)benzoic acid
Chemical Structure Depiction of
3-(5-{[(5-{[(furan-2-yl)methyl]carbamoyl}-1-methyl-1H-pyrazol-4-yl)imino]methyl}furan-2-yl)benzoic acid
3-(5-{[(5-{[(furan-2-yl)methyl]carbamoyl}-1-methyl-1H-pyrazol-4-yl)imino]methyl}furan-2-yl)benzoic acid
Compound characteristics
| Compound ID: | Y502-1801 |
| Compound Name: | 3-(5-{[(5-{[(furan-2-yl)methyl]carbamoyl}-1-methyl-1H-pyrazol-4-yl)imino]methyl}furan-2-yl)benzoic acid |
| Molecular Weight: | 418.41 |
| Molecular Formula: | C22 H18 N4 O5 |
| Smiles: | Cn1c(C(NCc2ccco2)=O)c(cn1)/N=C/c1ccc(c2cccc(c2)C(O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2589 |
| logD: | -0.2538 |
| logSw: | -3.4069 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.324 |
| InChI Key: | LEEYPCJSZMJKHB-UHFFFAOYSA-N |