N-(4-bromophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
N-(4-bromophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Compound characteristics
| Compound ID: | C071-0528 |
| Compound Name: | N-(4-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(Nc1ccc(cc1)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4137 |
| logD: | 4.4124 |
| logSw: | -4.4026 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.263 |
| InChI Key: | XQRCLXJXXUGFPC-UHFFFAOYSA-N |