N-(4-bromophenyl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
N-(4-bromophenyl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Compound characteristics
| Compound ID: | C071-0411 |
| Compound Name: | N-(4-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(Nc1ccc(cc1)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4484 |
| logD: | 4.447 |
| logSw: | -4.4524 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.632 |
| InChI Key: | JJMWQQVCGNTTHE-UHFFFAOYSA-N |