4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}-N,N-diethylbenzamide
Chemical Structure Depiction of
4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}-N,N-diethylbenzamide
4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}-N,N-diethylbenzamide
Compound characteristics
| Compound ID: | 5498-2674 |
| Compound Name: | 4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}-N,N-diethylbenzamide |
| Molecular Weight: | 488.97 |
| Molecular Formula: | C27 H25 Cl N4 O3 |
| Smiles: | CCN(CC)C(c1ccc(cc1)NC(CN1C(c2ccccc2C(c2ccc(cc2)[Cl])=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7117 |
| logD: | 3.7116 |
| logSw: | -4.3325 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.277 |
| InChI Key: | SHYVGLBHJBSBMW-UHFFFAOYSA-N |