2-(3-methylphenoxy)-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}acetamide
Chemical Structure Depiction of
2-(3-methylphenoxy)-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}acetamide
2-(3-methylphenoxy)-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}acetamide
Compound characteristics
| Compound ID: | D305-0774 |
| Compound Name: | 2-(3-methylphenoxy)-N-{1-methyl-2-[(4-propanoylpiperazin-1-yl)methyl]-1H-benzimidazol-5-yl}acetamide |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C25 H31 N5 O3 |
| Smiles: | CCC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)NC(COc1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8212 |
| logD: | 2.227 |
| logSw: | -3.1468 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.535 |
| InChI Key: | WXXQNMOTWWWEAU-UHFFFAOYSA-N |