propyl 2-{4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
propyl 2-{4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
propyl 2-{4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | C071-0551 |
| Compound Name: | propyl 2-{4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 686.73 |
| Molecular Formula: | C29 H33 F3 N4 O8 S2 |
| Smiles: | CCCOC(c1c(C)c(C(N(C)C)=O)sc1NC(CCCS(c1nc(cc(C(F)(F)F)n1)c1ccc(c(c1)OC)OC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2738 |
| logD: | 0.7265 |
| logSw: | -3.7743 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 122.105 |
| InChI Key: | VAIPNGNMWURBLJ-UHFFFAOYSA-N |