N'-[(3,4-dichlorophenyl)carbamoyl]-N-(4,6-dimethylpyrimidin-2-yl)-3,4-dihydroisoquinoline-2(1H)-carboximidamide
Chemical Structure Depiction of
N'-[(3,4-dichlorophenyl)carbamoyl]-N-(4,6-dimethylpyrimidin-2-yl)-3,4-dihydroisoquinoline-2(1H)-carboximidamide
N'-[(3,4-dichlorophenyl)carbamoyl]-N-(4,6-dimethylpyrimidin-2-yl)-3,4-dihydroisoquinoline-2(1H)-carboximidamide
Compound characteristics
| Compound ID: | Y021-1568 |
| Compound Name: | N'-[(3,4-dichlorophenyl)carbamoyl]-N-(4,6-dimethylpyrimidin-2-yl)-3,4-dihydroisoquinoline-2(1H)-carboximidamide |
| Molecular Weight: | 469.37 |
| Molecular Formula: | C23 H22 Cl2 N6 O |
| Smiles: | Cc1cc(C)nc(N/C(=N/C(Nc2ccc(c(c2)[Cl])[Cl])=O)N2CCc3ccccc3C2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2327 |
| logD: | -0.5554 |
| logSw: | -5.699 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.335 |
| InChI Key: | VJCPCVJYPHSBFM-UHFFFAOYSA-N |