N-(2-bromophenyl)-5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(2-bromophenyl)-5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxamide
N-(2-bromophenyl)-5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D053-0098 |
| Compound Name: | N-(2-bromophenyl)-5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 404.67 |
| Molecular Formula: | C13 H11 Br Cl N3 O3 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(CC)(=O)=O)[Cl])=O)c1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7816 |
| logD: | 2.666 |
| logSw: | -3.5016 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.081 |
| InChI Key: | KWOUSQGJWWYSIB-UHFFFAOYSA-N |