6,7-dimethoxy-4-methyl-3-(2-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}-2-oxoethyl)-2H-1-benzopyran-2-one--hydrogen chloride (1/2)
Chemical Structure Depiction of
6,7-dimethoxy-4-methyl-3-(2-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}-2-oxoethyl)-2H-1-benzopyran-2-one--hydrogen chloride (1/2)
6,7-dimethoxy-4-methyl-3-(2-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}-2-oxoethyl)-2H-1-benzopyran-2-one--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | Y040-4677 |
| Compound Name: | 6,7-dimethoxy-4-methyl-3-(2-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}-2-oxoethyl)-2H-1-benzopyran-2-one--hydrogen chloride (1/2) |
| Molecular Weight: | 559.49 |
| Molecular Formula: | C25 H34 N4 O6 |
| Salt: | 2HCl |
| Smiles: | CC1=C(CC(N2CCN(CC2)CC(N2CCN(C)CC2)=O)=O)C(=O)Oc2cc(c(cc12)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 0.234 |
| logD: | 0.1033 |
| logSw: | -1.3142 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.951 |
| InChI Key: | JVQWJUJIEXOIQP-UHFFFAOYSA-N |