ethyl N-(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate
ethyl N-(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate
Compound characteristics
| Compound ID: | L679-0510 |
| Compound Name: | ethyl N-(4-{[3-(3-methylphenyl)-3H-imidazo[4,5-b]pyridin-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C24 H30 N6 O3 |
| Smiles: | CCOC(CCNC(N1CCN(CC1)Cc1nc2cccnc2n1c1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.236 |
| logD: | 2.2151 |
| logSw: | -2.6927 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.397 |
| InChI Key: | XBWBVHITTVIUMC-UHFFFAOYSA-N |