methyl 4-{[5-chloro-2-(piperidin-1-yl)pyrimidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[5-chloro-2-(piperidin-1-yl)pyrimidine-4-carbonyl]amino}benzoate
methyl 4-{[5-chloro-2-(piperidin-1-yl)pyrimidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 8019-6139 |
| Compound Name: | methyl 4-{[5-chloro-2-(piperidin-1-yl)pyrimidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 374.83 |
| Molecular Formula: | C18 H19 Cl N4 O3 |
| Smiles: | COC(c1ccc(cc1)NC(c1c(cnc(n1)N1CCCCC1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7473 |
| logD: | 3.741 |
| logSw: | -4.1877 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.746 |
| InChI Key: | AOAKARJXIWXGEW-UHFFFAOYSA-N |