N-(2-bromophenyl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Chemical Structure Depiction of
N-(2-bromophenyl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
N-(2-bromophenyl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Compound characteristics
| Compound ID: | C071-0422 |
| Compound Name: | N-(2-bromophenyl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide |
| Molecular Weight: | 558.37 |
| Molecular Formula: | C22 H19 Br F3 N3 O4 S |
| Smiles: | COc1ccccc1c1cc(C(F)(F)F)nc(n1)S(CCCC(Nc1ccccc1[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8773 |
| logD: | 3.8771 |
| logSw: | -4.1057 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.934 |
| InChI Key: | CRSINXVOSJKHJI-UHFFFAOYSA-N |