N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
| Compound ID: | J076-0560 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
| Molecular Weight: | 487.99 |
| Molecular Formula: | C27 H26 Cl N5 O2 |
| Smiles: | C1CN(Cc2ccc(cc2)[Cl])C(N(C1)c1ccc(cc1)C(NCCc1nc2ccccc2[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3199 |
| logD: | 4.3193 |
| logSw: | -4.667 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.333 |
| InChI Key: | VKNQAWSMOPANOA-UHFFFAOYSA-N |