3-[({2-methyl-4-[1-(pyridine-3-carbonyl)piperidin-4-yl]pyrimidine-5-carbonyl}amino)methyl]benzoic acid
Chemical Structure Depiction of
3-[({2-methyl-4-[1-(pyridine-3-carbonyl)piperidin-4-yl]pyrimidine-5-carbonyl}amino)methyl]benzoic acid
3-[({2-methyl-4-[1-(pyridine-3-carbonyl)piperidin-4-yl]pyrimidine-5-carbonyl}amino)methyl]benzoic acid
Compound characteristics
| Compound ID: | ZC47-0112 |
| Compound Name: | 3-[({2-methyl-4-[1-(pyridine-3-carbonyl)piperidin-4-yl]pyrimidine-5-carbonyl}amino)methyl]benzoic acid |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C25 H25 N5 O4 |
| Smiles: | Cc1ncc(C(NCc2cccc(c2)C(O)=O)=O)c(C2CCN(CC2)C(c2cccnc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9018 |
| logD: | -1.4596 |
| logSw: | -2.1983 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.431 |
| InChI Key: | WFJYBZMFBIFQGA-UHFFFAOYSA-N |