methyl 2-[(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
methyl 2-[(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | L679-0503 |
| Compound Name: | methyl 2-[(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate |
| Molecular Weight: | 484.56 |
| Molecular Formula: | C27 H28 N6 O3 |
| Smiles: | Cc1cccc(c1)n1c(CN2CCN(CC2)C(Nc2ccccc2C(=O)OC)=O)nc2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 3.6142 |
| logD: | 3.5925 |
| logSw: | -3.6596 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.279 |
| InChI Key: | SQROMFSWUDLCQM-UHFFFAOYSA-N |