N-{2-[(morpholin-4-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-{2-[(morpholin-4-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
N-{2-[(morpholin-4-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide
Compound characteristics
| Compound ID: | D305-1646 |
| Compound Name: | N-{2-[(morpholin-4-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-(4-nitrophenoxy)acetamide |
| Molecular Weight: | 453.5 |
| Molecular Formula: | C23 H27 N5 O5 |
| Smiles: | CCCn1c2ccc(cc2nc1CN1CCOCC1)NC(COc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2542 |
| logD: | 3.2496 |
| logSw: | -3.4501 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.793 |
| InChI Key: | TWBQYSKHVPFGQU-UHFFFAOYSA-N |