diethyl 5-{[2-(4-fluorobenzoyl)hydrazinylidene]methyl}-3-methyl-1H-pyrrole-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-{[2-(4-fluorobenzoyl)hydrazinylidene]methyl}-3-methyl-1H-pyrrole-2,4-dicarboxylate
diethyl 5-{[2-(4-fluorobenzoyl)hydrazinylidene]methyl}-3-methyl-1H-pyrrole-2,4-dicarboxylate
Compound characteristics
| Compound ID: | K206-0090 |
| Compound Name: | diethyl 5-{[2-(4-fluorobenzoyl)hydrazinylidene]methyl}-3-methyl-1H-pyrrole-2,4-dicarboxylate |
| Molecular Weight: | 389.38 |
| Molecular Formula: | C19 H20 F N3 O5 |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)[nH]c1/C=N/NC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2042 |
| logD: | 3.1957 |
| logSw: | -3.3095 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.732 |
| InChI Key: | KNJVLVGHWVQJGZ-UHFFFAOYSA-N |