N-benzyl-N-(2-{[1,4-bis(4-methylphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-N-(2-{[1,4-bis(4-methylphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
N-benzyl-N-(2-{[1,4-bis(4-methylphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V024-6401 |
| Compound Name: | N-benzyl-N-(2-{[1,4-bis(4-methylphenyl)-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 558.64 |
| Molecular Formula: | C34 H30 N4 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1cn(c2ccc(C)cc2)c(NC(CN(Cc2ccccc2)C(c2ccc3c(c2)OCO3)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.6147 |
| logD: | 6.6146 |
| logSw: | -5.5113 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.508 |
| InChI Key: | FWNRSRHAYYSUAM-UHFFFAOYSA-N |