N-{2-[2-(2-ethylbutanamido)ethyl]-1-methyl-1H-benzimidazol-5-yl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{2-[2-(2-ethylbutanamido)ethyl]-1-methyl-1H-benzimidazol-5-yl}-4-fluorobenzamide
N-{2-[2-(2-ethylbutanamido)ethyl]-1-methyl-1H-benzimidazol-5-yl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | D516-0218 |
| Compound Name: | N-{2-[2-(2-ethylbutanamido)ethyl]-1-methyl-1H-benzimidazol-5-yl}-4-fluorobenzamide |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C23 H27 F N4 O2 |
| Smiles: | CCC(CC)C(NCCc1nc2cc(ccc2n1C)NC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6996 |
| logD: | 3.6938 |
| logSw: | -3.9707 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.842 |
| InChI Key: | KMCIFQCSEGWYNO-UHFFFAOYSA-N |