ethyl 2-(4-butoxyphenyl)-4-chloropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-butoxyphenyl)-4-chloropyrimidine-5-carboxylate
ethyl 2-(4-butoxyphenyl)-4-chloropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 4501-0042 |
| Compound Name: | ethyl 2-(4-butoxyphenyl)-4-chloropyrimidine-5-carboxylate |
| Molecular Weight: | 334.8 |
| Molecular Formula: | C17 H19 Cl N2 O3 |
| Smiles: | CCCCOc1ccc(cc1)c1ncc(C(=O)OCC)c(n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8879 |
| logD: | 4.8879 |
| logSw: | -4.8403 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.869 |
| InChI Key: | WKPQTIUMQULDBY-UHFFFAOYSA-N |