N-(2-{[1-(3-chloro-4-fluorophenyl)-4-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(2-methylpropyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(2-{[1-(3-chloro-4-fluorophenyl)-4-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(2-methylpropyl)-2H-1,3-benzodioxole-5-carboxamide
N-(2-{[1-(3-chloro-4-fluorophenyl)-4-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(2-methylpropyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V027-2661 |
| Compound Name: | N-(2-{[1-(3-chloro-4-fluorophenyl)-4-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-N-(2-methylpropyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 549 |
| Molecular Formula: | C29 H26 Cl F N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(Nc1nc(cn1c1ccc(c(c1)[Cl])F)c1ccccc1)=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0883 |
| logD: | 6.0883 |
| logSw: | -6.145 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.78 |
| InChI Key: | FACKRDNFCOYIGF-UHFFFAOYSA-N |