2-methyl 4-propyl 5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
2-methyl 4-propyl 5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2,4-dicarboxylate
2-methyl 4-propyl 5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | C071-0437 |
| Compound Name: | 2-methyl 4-propyl 5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 643.66 |
| Molecular Formula: | C27 H28 F3 N3 O8 S2 |
| Smiles: | CCCOC(c1c(C)c(C(=O)OC)sc1NC(CCCS(c1nc(cc(C(F)(F)F)n1)c1ccccc1OC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2664 |
| logD: | 1.3063 |
| logSw: | -4.4339 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.648 |
| InChI Key: | KUBMQHLMAKMFJL-UHFFFAOYSA-N |