4-[(7-chloro-2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one
Chemical Structure Depiction of
4-[(7-chloro-2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one
4-[(7-chloro-2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | Y043-3590 |
| Compound Name: | 4-[(7-chloro-2H-1,3-benzodioxol-5-yl)methyl]-6-phenylpyridazin-3(2H)-one |
| Molecular Weight: | 340.76 |
| Molecular Formula: | C18 H13 Cl N2 O3 |
| Smiles: | C(C1=CC(c2ccccc2)=NNC1=O)c1cc2c(c(c1)[Cl])OCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.2108 |
| logD: | 4.2108 |
| logSw: | -4.5776 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.961 |
| InChI Key: | ZQZBPQVODJVLMX-UHFFFAOYSA-N |