N-(2-bromophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Chemical Structure Depiction of
N-(2-bromophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
N-(2-bromophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Compound characteristics
| Compound ID: | C071-0539 |
| Compound Name: | N-(2-bromophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide |
| Molecular Weight: | 588.4 |
| Molecular Formula: | C23 H21 Br F3 N3 O5 S |
| Smiles: | COc1ccc(cc1OC)c1cc(C(F)(F)F)nc(n1)S(CCCC(Nc1ccccc1[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8426 |
| logD: | 3.8424 |
| logSw: | -4.1204 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.565 |
| InChI Key: | XVKPGAQBWHMLBZ-UHFFFAOYSA-N |