1-(4-chlorophenyl)-5-cyano-4-methyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
Chemical Structure Depiction of
1-(4-chlorophenyl)-5-cyano-4-methyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
1-(4-chlorophenyl)-5-cyano-4-methyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
Compound characteristics
| Compound ID: | 8013-5972 |
| Compound Name: | 1-(4-chlorophenyl)-5-cyano-4-methyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid |
| Molecular Weight: | 289.68 |
| Molecular Formula: | C13 H8 Cl N3 O3 |
| Smiles: | CC1=C(C#N)C(N(c2ccc(cc2)[Cl])N=C1C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7045 |
| logD: | -7.0545 |
| logSw: | -2.404 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.784 |
| InChI Key: | KRMJTYDBSIXBPJ-UHFFFAOYSA-N |