N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-3-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-3-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-3-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0583 |
| Compound Name: | N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-3-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 552.97 |
| Molecular Formula: | C27 H25 Cl N4 O7 |
| Smiles: | COc1cc(c(cc1NC(CNC(C1c2ccccc2C(N(c2ccc(c(c2)OC)OC)N=1)=O)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.2521 |
| logD: | 3.2481 |
| logSw: | -3.6801 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.434 |
| InChI Key: | BOZDNKWCVRDAJV-UHFFFAOYSA-N |