3-{[4-(2,5-dimethylphenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-{[4-(2,5-dimethylphenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
3-{[4-(2,5-dimethylphenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y503-0007 |
| Compound Name: | 3-{[4-(2,5-dimethylphenyl)-3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C24 H27 N O5 S |
| Smiles: | Cc1ccc(C)c(c1)c1c(C(=O)OC)c(NC(C2C3CCC(C3)C2C(O)=O)=O)sc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4823 |
| logD: | 1.8623 |
| logSw: | -4.4362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.279 |
| InChI Key: | TUIANXONBNCETF-UHFFFAOYSA-N |