N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2-[(2,4-dichlorophenyl)methyl]-1H-benzimidazol-1-yl}pentanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2-[(2,4-dichlorophenyl)methyl]-1H-benzimidazol-1-yl}pentanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2-[(2,4-dichlorophenyl)methyl]-1H-benzimidazol-1-yl}pentanamide
Compound characteristics
| Compound ID: | V018-1758 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{2-[(2,4-dichlorophenyl)methyl]-1H-benzimidazol-1-yl}pentanamide |
| Molecular Weight: | 510.42 |
| Molecular Formula: | C27 H25 Cl2 N3 O3 |
| Salt: | not_available |
| Smiles: | CCCC(C(NCc1ccc2c(c1)OCO2)=O)n1c2ccccc2nc1Cc1ccc(cc1[Cl])[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.713 |
| logD: | 6.7127 |
| logSw: | -6.2396 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.952 |
| InChI Key: | PPPQKGKZIHMTDL-QHCPKHFHSA-N |