N-[(3-chloro-4-fluorophenyl)methyl]-1-[5-(3-methylbutanamido)pyridin-2-yl]-1H-imidazole-4-carboxamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-1-[5-(3-methylbutanamido)pyridin-2-yl]-1H-imidazole-4-carboxamide
N-[(3-chloro-4-fluorophenyl)methyl]-1-[5-(3-methylbutanamido)pyridin-2-yl]-1H-imidazole-4-carboxamide
Compound characteristics
| Compound ID: | P035-0816 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-1-[5-(3-methylbutanamido)pyridin-2-yl]-1H-imidazole-4-carboxamide |
| Molecular Weight: | 429.88 |
| Molecular Formula: | C21 H21 Cl F N5 O2 |
| Smiles: | CC(C)CC(Nc1ccc(nc1)n1cc(C(NCc2ccc(c(c2)[Cl])F)=O)nc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0938 |
| logD: | 4.0933 |
| logSw: | -4.2848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.64 |
| InChI Key: | LQWAGHVFMWRWTQ-UHFFFAOYSA-N |