5-chloro-N-(2-ethoxyphenyl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(2-ethoxyphenyl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
5-chloro-N-(2-ethoxyphenyl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D053-0186 |
| Compound Name: | 5-chloro-N-(2-ethoxyphenyl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 383.85 |
| Molecular Formula: | C16 H18 Cl N3 O4 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(CCC)(=O)=O)[Cl])=O)c1ccccc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.1482 |
| logD: | 2.879 |
| logSw: | -3.4564 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.291 |
| InChI Key: | ZRFCWBDSECDNLP-UHFFFAOYSA-N |