N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
Compound ID: | J076-0483 |
Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(2-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
Molecular Weight: | 471.53 |
Molecular Formula: | C27 H26 F N5 O2 |
Smiles: | C1CN(Cc2ccccc2F)C(N(C1)c1ccc(cc1)C(NCCc1nc2ccccc2[nH]1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1514 |
logD: | 4.1508 |
logSw: | -4.2027 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.333 |
InChI Key: | DWHVMIJXXKFTBZ-UHFFFAOYSA-N |