N-(2,4-dimethylphenyl)-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide
N-(2,4-dimethylphenyl)-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | F045-0096 |
| Compound Name: | N-(2,4-dimethylphenyl)-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide |
| Molecular Weight: | 483.57 |
| Molecular Formula: | C28 H29 N5 O3 |
| Smiles: | Cc1ccc(c(C)c1)NC(c1ccc(CN2C(C=CC(=N2)N2CCN(CC2)c2ccccc2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4618 |
| logD: | 4.4617 |
| logSw: | -4.237 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.619 |
| InChI Key: | JMFLAAIIVZBLTR-UHFFFAOYSA-N |