methyl 4-carbamoyl-5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
methyl 4-carbamoyl-5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2-carboxylate
methyl 4-carbamoyl-5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | C071-0436 |
| Compound Name: | methyl 4-carbamoyl-5-{4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamido}-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 600.59 |
| Molecular Formula: | C24 H23 F3 N4 O7 S2 |
| Smiles: | Cc1c(C(N)=O)c(NC(CCCS(c2nc(cc(C(F)(F)F)n2)c2ccccc2OC)(=O)=O)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.6094 |
| logD: | 0.6679 |
| logSw: | -2.7128 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 132.659 |
| InChI Key: | JVSVSRWJIXKKQS-UHFFFAOYSA-N |