methyl 4-({2-[2-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}carbamamido)benzoate
Chemical Structure Depiction of
methyl 4-({2-[2-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}carbamamido)benzoate
methyl 4-({2-[2-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}carbamamido)benzoate
Compound characteristics
Compound ID: | F113-0393 |
Compound Name: | methyl 4-({2-[2-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}carbamamido)benzoate |
Molecular Weight: | 407.35 |
Molecular Formula: | C18 H16 F3 N5 O3 |
Smiles: | COC(c1ccc(cc1)NC(NCCn1c(C(F)(F)F)nc2cccnc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1573 |
logD: | 3.1573 |
logSw: | -3.385 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.964 |
InChI Key: | GCLNURYGSVVFRY-UHFFFAOYSA-N |