5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}-N-(prop-2-en-1-yl)furan-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}-N-(prop-2-en-1-yl)furan-2-carboxamide--hydrogen chloride (1/1)
5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}-N-(prop-2-en-1-yl)furan-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F045-0075 |
| Compound Name: | 5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}-N-(prop-2-en-1-yl)furan-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C23 H25 N5 O3 |
| Salt: | HCl |
| Smiles: | C=CCNC(c1ccc(CN2C(C=CC(=N2)N2CCN(CC2)c2ccccc2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1605 |
| logD: | 2.1604 |
| logSw: | -2.5757 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.752 |
| InChI Key: | CDQXWXXSWYXOIO-UHFFFAOYSA-N |