7,8-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
7,8-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide--hydrogen chloride (1/1)
7,8-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D491-8306 |
| Compound Name: | 7,8-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 459.97 |
| Molecular Formula: | C24 H29 N3 O4 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(C)o1)N1CCN(C)CC1)C(C1=CC(c2ccc(C)c(C)c2O1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2399 |
| logD: | 2.7598 |
| logSw: | -3.5825 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.713 |
| InChI Key: | ZIOGKXLGTFFIIX-IBGZPJMESA-N |