N-(2-{[4-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(2-{[4-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide
N-(2-{[4-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V025-0766 |
| Compound Name: | N-(2-{[4-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 577.04 |
| Molecular Formula: | C30 H29 Cl N4 O6 |
| Salt: | not_available |
| Smiles: | CC(C)N(CC(Nc1nc(cn1c1ccc(c(c1)OC)OC)c1ccc(cc1)[Cl])=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5952 |
| logD: | 5.5952 |
| logSw: | -6.0614 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.785 |
| InChI Key: | LPNPJJANLHTEKU-UHFFFAOYSA-N |