N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-benzimidazol-1-yl}propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-benzimidazol-1-yl}propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-benzimidazol-1-yl}propanamide
Compound characteristics
| Compound ID: | V027-5401 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)methyl]-5,6-dimethyl-1H-benzimidazol-1-yl}propanamide |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C27 H26 F N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1cc2c(cc1C)n(CCC(NCc1ccc3c(c1)OCO3)=O)c(Cc1ccc(cc1)F)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.3074 |
| logD: | 5.3054 |
| logSw: | -5.3446 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.437 |
| InChI Key: | LFGYJTAQGIMPOL-UHFFFAOYSA-N |