N-[(4-fluorophenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide--hydrogen chloride (1/1)
N-[(4-fluorophenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F045-0067 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-5-{[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1(6H)-yl]methyl}furan-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 523.99 |
| Molecular Formula: | C27 H26 F N5 O3 |
| Salt: | HCl |
| Smiles: | C(c1ccc(cc1)F)NC(c1ccc(CN2C(C=CC(=N2)N2CCN(CC2)c2ccccc2)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3599 |
| logD: | 3.3598 |
| logSw: | -3.4572 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.639 |
| InChI Key: | NPFPOWXUWQWASM-UHFFFAOYSA-N |