3-{[3-(ethoxycarbonyl)-4-(4-methylphenyl)thiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-{[3-(ethoxycarbonyl)-4-(4-methylphenyl)thiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
3-{[3-(ethoxycarbonyl)-4-(4-methylphenyl)thiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
Compound ID: | Y509-0576 |
Compound Name: | 3-{[3-(ethoxycarbonyl)-4-(4-methylphenyl)thiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid |
Molecular Weight: | 427.52 |
Molecular Formula: | C23 H25 N O5 S |
Smiles: | CCOC(c1c(csc1NC(C1C2CCC(C2)C1C(O)=O)=O)c1ccc(C)cc1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.2822 |
logD: | 1.6622 |
logSw: | -4.4437 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.859 |
InChI Key: | ZVGISPQPEQGMCF-UHFFFAOYSA-N |