2-acetyl-4-chlorophenyl 5-chloro-2-(propane-1-sulfonyl)pyrimidine-4-carboxylate
Chemical Structure Depiction of
2-acetyl-4-chlorophenyl 5-chloro-2-(propane-1-sulfonyl)pyrimidine-4-carboxylate
2-acetyl-4-chlorophenyl 5-chloro-2-(propane-1-sulfonyl)pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D650-0064 |
| Compound Name: | 2-acetyl-4-chlorophenyl 5-chloro-2-(propane-1-sulfonyl)pyrimidine-4-carboxylate |
| Molecular Weight: | 417.27 |
| Molecular Formula: | C16 H14 Cl2 N2 O5 S |
| Smiles: | CCCS(c1ncc(c(C(=O)Oc2ccc(cc2C(C)=O)[Cl])n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9846 |
| logD: | 2.9846 |
| logSw: | -3.5084 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.979 |
| InChI Key: | ZQIFNWVXLFQYAD-UHFFFAOYSA-N |