N-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
Compound ID: | C075-0158 |
Compound Name: | N-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
Molecular Weight: | 492.92 |
Molecular Formula: | C25 H21 Cl N4 O5 |
Smiles: | COc1ccc(cc1)N1C(c2ccccc2C(C(NCC(Nc2ccc(c(c2)[Cl])OC)=O)=O)=N1)=O |
Stereo: | ACHIRAL |
logP: | 3.7838 |
logD: | 3.7837 |
logSw: | -4.1689 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.785 |
InChI Key: | XKQMIJBHNCLWHW-UHFFFAOYSA-N |