N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2)
Chemical Structure Depiction of
N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2)
N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | D044-0101 |
| Compound Name: | N-{2-[(4-acetylpiperazin-1-yl)methyl]-1-methyl-1H-benzimidazol-5-yl}-2-(4-chlorophenoxy)acetamide--hydrogen chloride (1/2) |
| Molecular Weight: | 528.86 |
| Molecular Formula: | C23 H26 Cl N5 O3 |
| Salt: | 2HCl |
| Smiles: | CC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)NC(COc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5636 |
| logD: | 1.9694 |
| logSw: | -3.3164 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.53 |
| InChI Key: | USTBDEOKBVZNHU-UHFFFAOYSA-N |