N-[(3-methoxyphenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide
N-[(3-methoxyphenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | F045-0065 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide |
| Molecular Weight: | 499.57 |
| Molecular Formula: | C28 H29 N5 O4 |
| Smiles: | COc1cccc(CNC(c2ccc(CN3C(C=CC(=N3)N3CCN(CC3)c3ccccc3)=O)o2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4282 |
| logD: | 3.4281 |
| logSw: | -3.7924 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.183 |
| InChI Key: | OMKWLWRIQXWZJA-UHFFFAOYSA-N |