methyl 3-{[2-(3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl)ethyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 3-{[2-(3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl)ethyl]carbamamido}benzoate
methyl 3-{[2-(3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl)ethyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | F872-0450 |
| Compound Name: | methyl 3-{[2-(3-phenyl-3H-imidazo[4,5-b]pyridin-2-yl)ethyl]carbamamido}benzoate |
| Molecular Weight: | 415.45 |
| Molecular Formula: | C23 H21 N5 O3 |
| Smiles: | COC(c1cccc(c1)NC(NCCc1nc2cccnc2n1c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5939 |
| logD: | 3.5937 |
| logSw: | -3.786 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.434 |
| InChI Key: | XOMSGTCPGDTSKN-UHFFFAOYSA-N |