4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(4-chloro-3-methylphenoxy)-2-(3-fluorophenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(4-chloro-3-methylphenoxy)-2-(3-fluorophenyl)pyridazin-3(2H)-one
4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(4-chloro-3-methylphenoxy)-2-(3-fluorophenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | V027-4253 |
| Compound Name: | 4-[3-(4-acetylpiperazine-1-carbonyl)anilino]-5-(4-chloro-3-methylphenoxy)-2-(3-fluorophenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 576.03 |
| Molecular Formula: | C30 H27 Cl F N5 O4 |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)C(c1cccc(c1)NC1=C(C=NN(C1=O)c1cccc(c1)F)Oc1ccc(c(C)c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4845 |
| logD: | 4.4772 |
| logSw: | -4.5758 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.16 |
| InChI Key: | DCOTXILUKFMJQL-UHFFFAOYSA-N |