3-(3-chloro-4-methoxyphenyl)-N-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-N-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-4-oxo-3,4-dihydrophthalazine-1-carboxamide
3-(3-chloro-4-methoxyphenyl)-N-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0409 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-N-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 566.44 |
| Molecular Formula: | C28 H25 Cl2 N5 O4 |
| Smiles: | COc1ccc(cc1[Cl])N1C(c2ccccc2C(C(NCC(N2CCN(CC2)c2cccc(c2)[Cl])=O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8699 |
| logD: | 3.8698 |
| logSw: | -4.2508 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.744 |
| InChI Key: | JERJMIKTGSBCAP-UHFFFAOYSA-N |