methyl 2-[(4-{[3-(3-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(4-{[3-(3-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
methyl 2-[(4-{[3-(3-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | L679-0594 |
| Compound Name: | methyl 2-[(4-{[3-(3-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate |
| Molecular Weight: | 488.52 |
| Molecular Formula: | C26 H25 F N6 O3 |
| Smiles: | COC(c1ccccc1NC(N1CCN(CC1)Cc1nc2cccnc2n1c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1913 |
| logD: | 3.1893 |
| logSw: | -3.4714 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.279 |
| InChI Key: | HQGVCGUKOKDVDJ-UHFFFAOYSA-N |