N-(3-chloro-4-fluorophenyl)-1-(3-ethyl-6-methyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrimidin-5-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-1-(3-ethyl-6-methyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrimidin-5-yl)piperidine-4-carboxamide
N-(3-chloro-4-fluorophenyl)-1-(3-ethyl-6-methyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrimidin-5-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F666-0731 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-1-(3-ethyl-6-methyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrimidin-5-yl)piperidine-4-carboxamide |
| Molecular Weight: | 484.96 |
| Molecular Formula: | C25 H26 Cl F N4 O3 |
| Smiles: | CCN1C(C(=C(C)N(C1=O)c1ccccc1)N1CCC(CC1)C(Nc1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7448 |
| logD: | 3.1989 |
| logSw: | -4.0945 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.614 |
| InChI Key: | STOXODGGCQADMN-UHFFFAOYSA-N |