ethyl 3-{[2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carbonyl]amino}benzoate
ethyl 3-{[2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carbonyl]amino}benzoate
Compound characteristics
Compound ID: | M475-0112 |
Compound Name: | ethyl 3-{[2-phenyl-4-(pyridin-4-yl)pyrimidine-5-carbonyl]amino}benzoate |
Molecular Weight: | 424.46 |
Molecular Formula: | C25 H20 N4 O3 |
Smiles: | CCOC(c1cccc(c1)NC(c1cnc(c2ccccc2)nc1c1ccncc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5449 |
logD: | 4.5444 |
logSw: | -4.0865 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.832 |
InChI Key: | HWEQHDFJGGEHQH-UHFFFAOYSA-N |